SCHEMBL9505737

SCHEMBL9505737

CC(c1ccccc1)c1ccccc1C(C)c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
TDP1 Q9NUW8 4/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 4/20 0.51
HSD17B10 Q99714 3/20 0.51
KMT2A Q03164 3/20 0.51
CYP2C9 P11712 2/20 0.51
MEN1 O00255 2/20 0.51
CYP2C19 P33261 2/20 0.51
GRM1 Q13255 1/20 0.51
TYR P14679 1/20 0.49
HNF4A P41235 4/20 0.47
ACMSD Q8TDX5 3/20 0.47
MCL1 Q07820 3/20 0.47
DHFR P00374 1/20 0.47
CSNK2A1 P68400 1/20 0.46
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA12 O43570 2/20 0.44
CA7 P43166 2/20 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
SCHEMBL658651 0.92 KDM4E (0.56) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL1373696 0.92 KDM4E (0.56) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL5964731 0.90 KDM4E (0.54) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL2833452 0.85 KDM4E (0.62) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL27396609 0.84 ACMSD (0.65) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL8428483 0.82 CA1 (0.58) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL5884677 0.82 ACMSD (0.62) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL15881442 0.81 CA1 (0.58) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL11755689 0.81 CA1 (0.53) ALDH1A1TDP1KDM4EHPGDHSD17B10
SCHEMBL11758511 0.81 TYR (0.56) ALDH1A1TDP1KDM4EHPGDHSD17B10

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-0322091-B1 PROCESS FOR PREPARING ZINC SALT OF SALICYCLIC ACID COMPOUND Fuji Photo Film Co., Ltd. (JP) 1993-08-11 EP disclosed
US-5110848-A Organic compound in water; dispersant mixture FUJI PHOTO FILM CO., LTD. (JP) 1992-05-05 US disclosed
US-4914219-A Process for preparing zinc salt of salicylic acid compound FUJI PHOTO FILM CO., LTD. (JP) 1990-04-03 US disclosed