SCHEMBL9769812

SCHEMBL9769812

CC(Cc1ccccc1)c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 2/20 0.54
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 4/20 0.50
HSD17B10 Q99714 4/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2C9 P11712 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
GRM1 Q13255 1/20 0.50
ACMSD Q8TDX5 5/20 0.48
KLKB1 P03952 1/20 0.47
CTSB P07858 1/20 0.47
MMP9 P14780 1/20 0.47
DNMT1 P26358 1/20 0.47
DNMT3B Q9UBC3 1/20 0.47
DNMT3L Q9UJW3 1/20 0.47
DNMT3A Q9Y6K1 1/20 0.47
MCL1 Q07820 3/20 0.46

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
SCHEMBL8579980 0.88 HSD17B10 (0.47) KDM4EALDH1A1HSD17B10TDP1CYP2C19
SCHEMBL9505745 0.83 HNF4A (0.49) HNF4AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9453507 0.82 HNF4A (0.48) HNF4AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5885088 0.81 ALDH1A1 (0.57) KDM4EALDH1A1HPGDHSD17B10TDP1
SCHEMBL1098812 0.81 CYP2C9 (0.50) ALDH1A1HSD17B10TDP1CYP2C19CYP2C9
SCHEMBL9253511 0.80 FOLH1 (0.40) KDM4EALDH1A1HPGDESR1ESR2
SCHEMBL1098751 0.80 MEN1 (0.46) ALDH1A1HSD17B10TDP1CYP2C19CYP2C9
SCHEMBL16973200 0.80 ESR1 (0.49) ESR1ESR2CYP2D6ADRB2SLC6A2
SCHEMBL28481915 0.80 ESR1 (0.49) ALDH1A1HPGDHSD17B10ESR1ESR2
SCHEMBL9507231 0.79 NPC1 (0.43) MCL1ESR1ESR2SLC6A2SLC6A4

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