SCHEMBL31387426

SCHEMBL31387426

CC(C)c1ccc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 4/20 0.63
▸ PARP1 P09874 4/20 0.63
▸ TNKS2 Q9H2K2 4/20 0.63
▸ ALOX5 P09917 4/20 0.63
▸ POLH Q9Y253 4/20 0.63
▸ CYP3A4 P08684 4/20 0.63
▸ MAPT P10636 4/20 0.63
▸ ALOX15 P16050 4/20 0.63
▸ IP6K2 Q9UHH9 4/20 0.63
▸ HPGD P15428 3/20 0.63
▸ SMN1; SMN2 Q16637 3/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ HSD17B10 Q99714 3/20 0.63
▸ MAPK1 P28482 2/20 0.63
▸ ALDH1A1 P00352 2/20 0.63
▸ FTO Q9C0B1 2/20 0.63
▸ ST6GAL1 P15907 1/20 0.63
▸ DHODH Q02127 1/20 0.63
▸ HDAC6 Q9UBN7 2/20 0.58
▸ PARP2 Q9UGN5 1/20 0.58

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
SCHEMBL29664594 0.82 ALOX5 (0.78) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL491032 0.82 ALOX5 (0.78) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL30591365 0.82 ALOX5 (0.78) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL22166315 0.81 TNKS (0.72) TNKSPARP1TNKS2CYP3A4MAPT
SCHEMBL2218499 0.80 POLH (0.75) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL31387505 0.79 ALOX5 (0.63) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL31387550 0.78 MAPT (0.74) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL10037938 0.78 CSNK2A2 (0.74) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL345706 0.77 TNKS (1.00) TNKSPARP1TNKS2ALOX5POLH
SCHEMBL29664745 0.77 TNKS (1.00) TNKSPARP1TNKS2ALOX5POLH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025019587-A1 SENOTHERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2025-01-23 — — WO disclosed
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