SCHEMBL9769817

SCHEMBL9769817

CC(C)c1ccc(O)c(C(=O)O)c1.c1cc2cc-2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 6/20 0.63
MCL1 Q07820 4/20 0.57
DHFR P00374 1/20 0.57
HNF4A P41235 1/20 0.57
RXRA P19793 2/20 0.54
RXRB P28702 1/20 0.54
RXRG P48443 1/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
CYP2C9 P11712 1/20 0.53
MEN1 O00255 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53
GRM1 Q13255 1/20 0.53
HSP90AA1 P07900 2/20 0.51
HSP90AB1 P08238 2/20 0.51
CSNK2A1 P68400 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
SCHEMBL1649282 0.90 ALDH1A1 (0.62) ACMSDMCL1DHFRHNF4AKDM4E
SCHEMBL5884677 0.83 ACMSD (0.62) ACMSDMCL1DHFRHNF4ARXRA
SCHEMBL11481523 0.80 KDM4E (0.56) MCL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL27396609 0.79 ACMSD (0.65) ACMSDMCL1DHFRHNF4AKDM4E
SCHEMBL2833452 0.79 KDM4E (0.62) ACMSDMCL1DHFRHNF4AKDM4E
SCHEMBL14381820 0.78 KDM4E (0.61) ACMSDMCL1DHFRHNF4AKDM4E
SCHEMBL8373102 0.77 ACMSD (0.67) ACMSDMCL1DHFRHNF4ARXRA
SCHEMBL6499038 0.77 FOLH1 (0.53) RXRARXRBRXRGHPGDHSD17B10
SCHEMBL658651 0.77 KDM4E (0.56) ACMSDMCL1DHFRHNF4AKDM4E
SCHEMBL1373696 0.77 KDM4E (0.56) ACMSDMCL1DHFRHNF4AKDM4E

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