SCHEMBL9962883

SCHEMBL9962883

CCN1CCN(C(c2ccc(C(F)(F)F)cc2)c2ccc3cccnc3c2O)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 1.00
HSP90AA1 P07900 3/20 1.00
ATM Q13315 1/20 1.00
MCL1 Q07820 1/20 0.71
P4HB P07237 3/20 0.59
ALDH1A1 P00352 6/20 0.55
ALOX12 P18054 6/20 0.55
ESR2 Q92731 4/20 0.55
HTT P42858 4/20 0.55
TP53 P04637 3/20 0.55
ALOX15 P16050 3/20 0.55
MEN1 O00255 2/20 0.55
MAPK1 P28482 2/20 0.55
BRAF P15056 1/20 0.55
KDM4E B2RXH2 6/20 0.53
MAPT P10636 6/20 0.53
NPSR1 Q6W5P4 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29549198 1.00 KMT2A (1.00) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL24089085 0.88 KMT2A (0.78) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL16696558 0.87 KMT2A (0.78) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL30868623 0.87 P4HB (0.78) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL16697070 0.85 KMT2A (0.74) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL16696529 0.85 HSP90AA1 (0.74) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL16696545 0.85 KMT2A (0.73) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL16696534 0.84 KMT2A (0.72) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL15781873 0.83 ALDH1A1 (0.79) KMT2AHSP90AA1ATMMCL1P4HB
SCHEMBL24505632 0.82 KMT2A (0.70) KMT2AHSP90AA1ATMMCL1P4HB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2863920-B1 QUINOLINE DERIVATIVES FOR USE IN THE TRATMENT OF BREAST CANCER EUTROPICS PHARMACEUTICALS INC (US) 2023-03-22 EP claimed
US-20180221366-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES EUTROPICS PHARMACEUTICALS, INC. 2018-08-09 US claimed
US-20150150869-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES EUTROPICS PHARMACEUTICALS, INC. 2015-06-04 US claimed
US-20150133450-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES EUTROPICS PHARMACEUTICALS INC (US) 2015-05-14 US claimed
EP-2863920-B1 QUINOLINE DERIVATIVES FOR USE IN THE TRATMENT OF BREAST CANCER EUTROPICS PHARMACEUTICALS INC (US) 2023-03-22 EP disclosed
US-20210379078-A1 Killing Senescent Cells And Treating Senescence-Associated Conditions Using A Bcl Inhibitor And An Mcl-1 Inhibitor UNITY BIOTECHNOLOGY, INC. 2021-12-09 US disclosed
US-20210299128-A1 COMPOUNDS FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA RIKEN (JP) 2021-09-30 US disclosed
WO-2021188417-A1 COMPOUNDS FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA FLASH THERAPEUTICS, LLC (US) 2021-09-23 WO disclosed
US-10765673-B2 Methods and compositions useful for treating diseases involving Bcl-2 family proteins with quinoline derivatives EUTROPICS PHARMACEUTICALS, INC. (US) 2020-09-08 US disclosed
US-10413549-B2 Methods and compositions useful for treating diseases involving Bcl-2 family proteins with isoquinoline and quinoline derivatives EUTROPICS PHARMACEUTICALS, INC. (US) 2019-09-17 US disclosed
US-20180221366-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES EUTROPICS PHARMACEUTICALS, INC. 2018-08-09 US disclosed
EP-2922544-B1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES EUTROPICS PHARMACEUTICALS INC (US) 2018-08-01 EP disclosed
US-20140134163-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS Errico, Joseph P. (US) 2014-05-15 US disclosed
US-8658170-B2 Combination therapy with MDM2 and EFGR inhibitors Errico, Joseph P. (US) 2014-02-25 US disclosed
US-8658170-B2 Combination therapy with MDM2 and EFGR inhibitors Errico, Joseph P. (US) 2014-02-25 US disclosed
US-20120156197-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS Errico, Joseph P. (US) 2012-06-21 US disclosed
US-20120156197-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS Errico, Joseph P. (US) 2012-06-21 US disclosed
WO-2012012653-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS ERRICO JOSEPH P (US) 2012-01-26 WO disclosed
US-20110301193-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2011-12-08 US disclosed
US-20110301193-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2011-12-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10765673-B2 Methods and compositions useful for treating diseases involving Bcl-2 family proteins with quinoline derivatives BCL3, BCL6, MCL1 KMT2A 720/4885HSP90AA1 859/4885ATM 4037/4885
US-20180221366-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES BCL3, BCL6, MCL1 KMT2A 720/4885HSP90AA1 859/4885ATM 4037/4885
US-20120156197-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS TP53, EGFR, MDM2 KMT2A 3490/4885HSP90AA1 356/4885ATM 335/4885
US-20110301193-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 KMT2A 3667/4885HSP90AA1 961/4885ATM 3462/4885
US-20150150869-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES BCL3, BCL6, MCL1 KMT2A 720/4885HSP90AA1 859/4885ATM 4037/4885
US-20210379078-A1 Killing Senescent Cells And Treating Senescence-Associated Conditions Using A Bcl Inhibitor And An Mcl-1 Inhibitor MCL1, BCL2, BCL2L1 KMT2A 2776/4885HSP90AA1 1692/4885ATM 829/4885
US-10413549-B2 Methods and compositions useful for treating diseases involving Bcl-2 family proteins with isoquinoline and quinoline derivatives BCL3, MCL1, BCL6 KMT2A 751/4885HSP90AA1 513/4885ATM 3416/4885
US-20140134163-A1 COMBINATION THERAPY WITH MDM2 AND EFGR INHIBITORS TP53, EGFR, MDM2 KMT2A 3490/4885HSP90AA1 356/4885ATM 335/4885
US-20210299128-A1 COMPOUNDS FOR TREATING OR INHIBITING RECURRENCE OF ACUTE MYELOID LEUKEMIA MCL1, FLT3, ABL1 KMT2A 115/4885HSP90AA1 1836/4885ATM 878/4885
US-20150133450-A1 METHODS AND COMPOSITIONS USEFUL FOR TREATING DISEASES INVOLVING BCL-2 FAMILY PROTEINS WITH QUINOLINE DERIVATIVES BCL3, BCL6, MCL1 KMT2A 720/4885HSP90AA1 859/4885ATM 4037/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.