SCHEMBL9327752

SCHEMBL9327752

O=C(O)c1ccccc1Cc1cccc(O)c1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 4/20 0.54
MCL1 Q07820 4/20 0.54
BCL2L1 Q07817 3/20 0.54
BAK1 Q16611 3/20 0.54
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
CA12 O43570 2/20 0.53
CA7 P43166 2/20 0.53
CA14 Q9ULX7 2/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HMGB1 P09429 1/20 0.52
HPGD P15428 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NAPRT Q6XQN6 1/20 0.52
TSHR P16473 1/20 0.51
KAT8 Q9H7Z6 3/20 0.50

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
SCHEMBL9308264 0.89 CA12 (0.67) BIDMCL1BCL2L1BAK1CA1
SCHEMBL10483666 0.87 TSHR (0.56) CA1CA2CA9CA12CA7
SCHEMBL8837284 0.86 HSPA5 (0.55) BIDMCL1BCL2L1BAK1CA1
SCHEMBL4731949 0.85 HSPA5 (0.64) CA1CA2CA9CA12CA7
SCHEMBL69352 0.83 TSHR (0.68) CA1CA2CA9CA12CA7
SCHEMBL5202410 0.82 BID (0.66) BIDMCL1BCL2L1BAK1CA1
SCHEMBL29367715 0.81 FOLH1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL31090800 0.81 FOLH1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL23708 0.81 FOLH1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL17938486 0.81 TSHR (0.66) CA1CA2CA9CA12CA7

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
EP-0362649-B1 Radiation-sensitive compositions and their use BASF AG (DE) 1994-03-02 EP claimed