SCHEMBL19004040

SCHEMBL19004040

COc1ccc(C(=O)c2ccccc2)c2c(O)ccc(C(=O)c3ccccc3)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 1.00
LMNA P02545 7/20 1.00
HTT P42858 4/20 1.00
NPSR1 Q6W5P4 3/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
KDM4E B2RXH2 3/20 0.65
HSD17B10 Q99714 3/20 0.65
MAPK1 P28482 3/20 0.65
ALOX15 P16050 1/20 0.65
HPGD P15428 5/20 0.59
CYP3A4 P08684 2/20 0.59
RECQL P46063 2/20 0.59
ALDH1A1 P00352 4/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2D6 P10635 2/20 0.55
CYP2C19 P33261 2/20 0.55
PGR P06401 1/20 0.55
SLC6A2 P23975 1/20 0.55
PDE4A P27815 1/20 0.55
HRH1 P35367 1/20 0.55

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
SCHEMBL19004092 0.85 LMNA (0.72) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL27879350 0.79 MAPT (0.66) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL93271 0.79 MAPT (1.00) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL2060403 0.76 MAPT (0.77) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL9339159 0.76 MAPT (0.77) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL6444260 0.76 MAPT (0.77) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL13121658 0.76 MAPT (0.70) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL613121 0.76 MAPT (0.66) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL30023422 0.76 MAPT (0.66) MAPTLMNAHTTNPSR1SMN1; SMN2
SCHEMBL9339940 0.76 MAPT (0.84) MAPTLMNAHTTNPSR1SMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210228535-A1 SMALL MOLECULES AGAINST CANCER BIOKINE THERAPEUTICS LTD. (IL) 2021-07-29 US disclosed
US-20210228535-A1 SMALL MOLECULES AGAINST CANCER BIOKINE THERAPEUTICS LTD. (IL) 2021-07-29 US disclosed
US-10959979-B2 Small molecules against cancer BIOKINE THERAPEUTICS LTD. (IL) 2021-03-30 US disclosed
US-10959979-B2 Small molecules against cancer BIOKINE THERAPEUTICS LTD. (IL) 2021-03-30 US disclosed
US-20200268709-A1 SMALL MOLECULES AGAINST CANCER BIOKINE THERAPEUTICS LTD. (IL) 2020-08-27 US disclosed
US-20200268709-A1 SMALL MOLECULES AGAINST CANCER BIOKINE THERAPEUTICS LTD. (IL) 2020-08-27 US disclosed
US-10646465-B2 Small molecules against cancer BIOKINE THERAPEUTICS LTD. (IL) 2020-05-12 US disclosed
US-10646465-B2 Small molecules against cancer BIOKINE THERAPEUTICS LTD. (IL) 2020-05-12 US disclosed
US-20190240188-A1 SMALL MOLECULES AGAINST CANCER ALONBIO LTD. (IL) 2019-08-08 US disclosed
US-20190240188-A1 SMALL MOLECULES AGAINST CANCER ALONBIO LTD. (IL) 2019-08-08 US disclosed
WO-2017103931-A1 SMALL MOLECULES AGAINST CANCER BIOKINE THERAPEUTICS LTD. (IL) 2017-06-22 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 (5 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-10959979-B2 Small molecules against cancer CCL2, CXCR2, CCL5 MAPT 4157/4885LMNA 4286/4885HTT 4017/4885
US-20210228535-A1 SMALL MOLECULES AGAINST CANCER CCL2, CXCR2, CCL5 MAPT 4157/4885LMNA 4286/4885HTT 4017/4885
US-10646465-B2 Small molecules against cancer CCL2, CXCR2, CCL5 MAPT 4157/4885LMNA 4286/4885HTT 4017/4885
US-20200268709-A1 SMALL MOLECULES AGAINST CANCER CCL2, CXCR2, CCL5 MAPT 4157/4885LMNA 4286/4885HTT 4017/4885
US-20190240188-A1 SMALL MOLECULES AGAINST CANCER CCL2, CXCR2, CCL5 MAPT 4157/4885LMNA 4286/4885HTT 4017/4885

“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.