SCHEMBL30375718

SCHEMBL30375718

Sc1ccc2c(c1)OCO2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.54
ALDH1A1 P00352 5/20 0.52
MAPK1 P28482 1/20 0.52
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
MAPK9 P45984 2/20 0.47
SRD5A2 P31213 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
ATM Q13315 1/20 0.45
CMA1 P23946 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
SLC6A4 P31645 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL3519494 1.00 CYP3A4 (0.54) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL1722920 0.85 TSHR (0.50) ATMKMT2AMAPTSMN1; SMN2GAA
SCHEMBL29472049 0.85 TSHR (0.50) ATMKMT2AMAPTSMN1; SMN2GAA
SCHEMBL24196489 0.81 NPC1 (0.49) ALDH1A1TDP1ATMKMT2AMAPT
SCHEMBL5682293 0.75 CYP3A4 (0.54) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL4606902 0.75 CYP3A4 (0.54) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL1045633 0.75 CYP3A4 (0.54) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL6351358 0.73 CYP3A4 (0.52) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL1486215 0.72 CYP3A4 (0.56) CYP3A4ALDH1A1MAPK1HSD17B10TDP1
SCHEMBL21451034 0.72 MEN1 (0.59) CYP3A4ALDH1A1MAPK1HSD17B10SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4582423-A1 NOVEL TRICYCLIC DERIVATIVE COMPOUND AND USES THEREOF Hanmi Pharm. Co., Ltd. (KR) 2025-07-09 EP disclosed
CN-120077041-A Tricyclic derivative compounds and use thereof 韩美药品株式会社 2025-05-30 CN disclosed
EP-4426681-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS Sitryx Therapeutics Limited (GB) 2024-09-11 EP disclosed
WO-2023079294-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS SITRYX THERAPEUTICS LIMITED (GB) 2023-05-11 WO disclosed