SCHEMBL3241401

SCHEMBL3241401

CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(Nc4nccn4-c4cc(NCCN5CCOCC5)ncn4)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.57
HTT P42858 3/20 0.55
NR2C2 P49116 8/20 0.54
HCK P08631 7/20 0.54
MAPK1 P28482 1/20 0.54
ATM Q13315 1/20 0.54
GCK P35557 2/20 0.54
MAP3K7 O43318 1/20 0.54
FES P07332 1/20 0.54
FER P16591 1/20 0.54
MAP4K2 Q12851 1/20 0.54
MAPK14 Q16539 1/20 0.54
ABL1 P00519 1/20 0.53
CLK1 P49759 1/20 0.51
EGFR P00533 1/20 0.51

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
SCHEMBL22337466 0.96 ABL1 (0.58) BRAFHCKABL1EGFR
SCHEMBL1841461 0.89 BRAF (0.69) BRAFHCK
SCHEMBL1825894 0.88 BRAF (0.58) BRAFHCKMAPK14
SCHEMBL1826267 0.88 BRAF (0.65) BRAFNR2C2HCKGCKMAP3K7
SCHEMBL13291949 0.87 NR2C2 (0.64) BRAFHTTNR2C2HCKMAPK1
SCHEMBL3229925 0.87 BRAF (0.66) BRAFHCKMAPK14
SCHEMBL3234828 0.87 NR2C2 (0.59) BRAFHTTNR2C2HCKMAPK1
SCHEMBL22337178 0.86 BRAF (0.56) BRAFHCKMAPK14
SCHEMBL19152879 0.86 BRAF (0.55) BRAFHCKMAPK14
SCHEMBL1833165 0.85 LCK (0.66) BRAFHCKMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758892-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-10-17 EP claimed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US claimed
US-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2007-09-27 US claimed
US-20220305016-A1 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS FOR TREATING OSTEOPOROSIS THE GENERAL HOSPITAL CORPORATION (US) 2022-09-29 US disclosed
US-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS THE GENERAL HOSPITAL CORPORATION (US) 2022-05-05 US disclosed
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis THE GENERAL HOSPITAL CORPORATION (US) 2022-02-08 US disclosed
US-20210147388-A1 IMIDAZOLYL KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-05-20 US disclosed
US-10975058-B2 Imidazolyl kinase inhibitors and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-13 US disclosed
EP-3171874-B1 IMIDAZOLYL KINASE INHIBITORS AND USES THEREOF DANA FARBER CANCER INST INC (US) 2020-11-18 EP disclosed
US-20200338087-A9 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-29 US disclosed
US-20200253981-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS THE GENERAL HOSPITAL CORPORATION (US) 2020-08-13 US disclosed
WO-2016023014-A2 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-02-11 WO disclosed
WO-2016014542-A1 IMIDAZOLYL KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-01-28 WO disclosed
EP-1758892-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-10-17 EP disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2007-09-27 US disclosed
EP-1758892-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-03-07 EP disclosed
WO-2005123719-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-12-29 WO 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 (8 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-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS SIK2, SIK1, SIK3 BRAF 206/4885HTT 4191/4885NR2C2 3350/4885
US-20200253981-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS SIK2, SIK1, SIK3 BRAF 206/4885HTT 4191/4885NR2C2 3350/4885
US-20220305016-A1 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS FOR TREATING OSTEOPOROSIS SOST, SIK2, SIK1 BRAF 1160/4885HTT 3638/4885NR2C2 1033/4885
US-10975058-B2 Imidazolyl kinase inhibitors and uses thereof PRKACB, PRKACG, PRKACA BRAF 151/4885HTT 1462/4885NR2C2 2518/4885
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis SOST, SIK2, SIK1 BRAF 1160/4885HTT 3638/4885NR2C2 1033/4885
US-20210147388-A1 IMIDAZOLYL KINASE INHIBITORS AND USES THEREOF PRKACB, PRKACG, PRKACA BRAF 151/4885HTT 1462/4885NR2C2 2518/4885
US-20200338087-A9 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS SIK1, SIK3, SIK2 BRAF 481/4885HTT 4494/4885NR2C2 3084/4885
US-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, PTK2B, SRC BRAF 17/4885HTT 2165/4885NR2C2 699/4885

“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.