SCHEMBL9769927

SCHEMBL9769927

CC(c1ccccc1)c1cccc(-c2cccc(O)c2C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
CA12 O43570 2/20 0.44
CA7 P43166 2/20 0.44
CA14 Q9ULX7 2/20 0.44
RXRA P19793 2/20 0.42
NR4A2 P43354 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
TYR P14679 2/20 0.39
FOLH1 Q04609 2/20 0.38
MCL1 Q07820 2/20 0.38
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MDM4 O15151 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL3264678 0.79 CA12 (0.64) CA1CA2CA9CA12CA7
Biphenyl SCHEMBL5316961 0.76 KMO (0.61) CA1CA2CA9CA12CA7
SCHEMBL8373102 0.75 ACMSD (0.67) RXRARXRBRXRGMCL1HNF4A
SCHEMBL4368940 0.75 FOLH1 (0.60) CA1CA2CA9CA12CA7
SCHEMBL29627562 0.75 AKR1C3 (0.55) RXRANR4A2ALDH1A1HPGDKDM4E
SCHEMBL9769821 0.74 CNR2 (0.55) CA1CA2CA9CA12CA7
SCHEMBL10046425 0.74 CA12 (0.80) CA1CA2CA9CA12CA7
SCHEMBL30375523 0.74 KDM1A (0.59) CA1CA2CA9CA12CA7
SCHEMBL8889619 0.74 CA12 (0.47) CA1CA2CA9CA12CA7
SCHEMBL9769804 0.74 RXRA (0.55) 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
US-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed