SCHEMBL9639622

SCHEMBL9639622

Cc1cc(C(=O)c2ccc(O)cc2O)c(O)c(O)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CES2 O00748 1/20 0.50
USP2 O75604 1/20 0.50
GAA P10253 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
CA12 O43570 4/20 0.48
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.48
CA14 Q9ULX7 4/20 0.48
ALDH1A1 P00352 4/20 0.48
TSHR P16473 1/20 0.48
NPC1 O15118 2/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9639062 0.86 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL3281937 0.84 CES2 (0.55) MEN1KMT2ACES2USP2GAA
SCHEMBL9639056 0.82 HDAC1 (0.55) MEN1KMT2AALDH1A1NPC1HPGD
SCHEMBL13557813 0.82 ALDH1A1 (0.57) MEN1KMT2ACES2USP2GAA
SCHEMBL9639971 0.81 HSP90AB1 (0.54) MEN1KMT2ACES2USP2GAA
SCHEMBL39507 0.81 CES2 (0.73) MEN1KMT2ACES2USP2GAA
SCHEMBL29357695 0.81 CES2 (0.73) MEN1KMT2ACES2USP2GAA
SCHEMBL11028801 0.81 MEN1 (0.61) MEN1KMT2ACES2USP2GAA
SCHEMBL9639812 0.79 MEN1 (0.50) MEN1KMT2ACES2USP2GAA
SCHEMBL10768130 0.79 FNTA (0.48) MEN1KMT2AALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0227487-B1 POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-07-15 EP disclosed
US-5087548-A POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., INC. (JP) 1992-02-11 US disclosed
EP-0227487-A2 Positive type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1987-07-01 EP disclosed