SCHEMBL13192068

SCHEMBL13192068

Nc1ccc(-c2ccc(O)cc2)nc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.57
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 2/20 0.48
CA3 P07451 1/20 0.48
CYP3A4 P08684 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
CA6 P23280 1/20 0.48
CASP1 P29466 1/20 0.48
HIF1A Q16665 1/20 0.48
CA14 Q9ULX7 1/20 0.48
MAPT P10636 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
STAT3 P40763 1/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LTA4H P09960 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46

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
SCHEMBL8974216 0.89 METAP2 (0.45) KDM1AALDH1A1HSD17B10CYP3A4CA6
SCHEMBL30337692 0.89 METAP2 (0.45) KDM1AALDH1A1HSD17B10CYP3A4CA6
SCHEMBL6804411 0.87 METAP2 (0.48) KDM1AALDH1A1HSD17B10CYP3A4CA6
SCHEMBL30087143 0.87 METAP2 (0.48) KDM1AALDH1A1HSD17B10CYP3A4CA6
SCHEMBL1491731 0.80 NPC1 (0.58) KDM1AALDH1A1HSD17B10MAPTNPC1
SCHEMBL6637174 0.79 USP7 (0.49) KDM1AHSD17B1HSD17B2USP7ALOX5
SCHEMBL18573201 0.79 NPC1 (0.49) KDM1AALDH1A1HSD17B10ALOX15MAPT
SCHEMBL9237008 0.79 KDM1A (0.57) KDM1AALDH1A1CYP3A4MAPTNPC1
SCHEMBL3173634 0.79 NPC1 (0.53) KDM1AALDH1A1NPC1RAB9AMEN1
SCHEMBL30436719 0.79 NPC1 (0.53) KDM1AALDH1A1NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400498-A1 AMORPHOUS SUBSTANCES, CRYSTALS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES OF THIOHYDANTOIN COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2024-07-17 EP disclosed
US-20230054270-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF SUZHOU KINTOR PHARMACEUTICALS, INC. (CN) 2023-02-23 US disclosed
EP-4119546-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Suzhou Kintor Pharmaceuticals, Inc. (CN) 2023-01-18 EP disclosed
CN-102036963-B Derivatives of quinolines and quinoxalines as protein tyrosine kinase inhibitors NOVARTIS AG 2013-08-21 CN disclosed
WO-2012137982-A9 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-14 WO disclosed
WO-2012137982-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-11 WO disclosed
CN-102036963-A Derivatives of quinolines and quinoxalines as protein tyrosine kinase inhibitors NOVARTIS AG 2011-04-27 CN 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 (1 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-20230054270-A1 BIFUNCTIONAL COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF AR, SHBG, NR5A1 KDM1A 1825/4885ALDH1A1 1653/4885HSD17B10 544/4885

“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.