SCHEMBL9769833

SCHEMBL9769833

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

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 4/20 0.65
PTGS2 P35354 2/20 0.40
MEN1 O00255 2/20 0.40
KDR P35968 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TNF P01375 1/20 0.40
CYP3A4 P08684 1/20 0.40
HSPD1 P10809 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
CYP2C19 P33261 1/20 0.40
BRCA1 P38398 1/20 0.40
RECQL P46063 1/20 0.40
CASP7 P55210 1/20 0.40
HSPE1 P61604 1/20 0.40

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
SCHEMBL9769837 0.88 ACMSD (0.59) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL9769937 0.82 ACMSD (0.70) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL11777656 0.81 ACMSD (0.72) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL9769869 0.81 ACMSD (0.72) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL27965931 0.78 ACMSD (1.00) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL2533359 0.78 ACMSD (1.00) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL27881571 0.76 ACMSD (0.86) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL21409535 0.75 ESR2 (0.50) CYP3A4CYP2C9
SCHEMBL9769797 0.74 ACMSD (0.58) ACMSDPTGS2MEN1KDRKMT2A
SCHEMBL9769884 0.73 ACMSD (0.60) ACMSDMCL1STAT3KLKB1CTSB

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