SCHEMBL9769797

SCHEMBL9769797

CC(c1ccccc1)C1CCCC(c2ccc(O)c(C(=O)O)c2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 6/20 0.58
MCL1 Q07820 3/20 0.40
HNF4A P41235 2/20 0.40
DHFR P00374 1/20 0.40
CYP2D6 P10635 1/20 0.39
ALOX15 P16050 2/20 0.38
USP2 O75604 1/20 0.38
STAT3 P40763 2/20 0.36
XDH P47989 1/20 0.36
DHODH Q02127 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TNF P01375 1/20 0.35
CYP3A4 P08684 1/20 0.35
HSPD1 P10809 1/20 0.35
THRB P10828 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL9769869 0.81 ACMSD (0.72) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL9769937 0.77 ACMSD (0.70) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL11777656 0.76 ACMSD (0.72) ACMSDHNF4AALOX15STAT3KDM4E
SCHEMBL9769833 0.74 ACMSD (0.65) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL9769884 0.74 ACMSD (0.60) ACMSDMCL1HNF4ADHFRSTAT3
SCHEMBL27965931 0.74 ACMSD (1.00) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL2533359 0.74 ACMSD (1.00) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL27881571 0.72 ACMSD (0.86) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL11773568 0.72 ACMSD (0.65) ACMSDMCL1HNF4ADHFRALOX15
SCHEMBL8376912 0.71 ACMSD (0.63) ACMSDSTAT3DHODHKDM4EMEN1

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 2 patents. 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
US-3983292-A Pressure sensitive recording papers SANKO CHEMICAL COMPANY LTD. (JA) 1976-09-28 US disclosed