SCHEMBL9507492

SCHEMBL9507492

c1ccc(-c2cccc(Oc3ccccc3-c3ccccc3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
PTGS2 P35354 1/20 0.50
AR P10275 1/20 0.49
BRD4 O60885 3/20 0.45
FFAR4 Q5NUL3 3/20 0.44
GSTP1 P09211 1/20 0.44
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR1 O14842 1/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41
GRM5 P41594 1/20 0.40
SCN9A Q15858 1/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
MAP3K8 P41279 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
SCHEMBL11817998 0.96 NCOA1 (0.58) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11820312 0.95 NCOA1 (0.53) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11816625 0.91 NCOA1 (0.49) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11817974 0.91 NCOA1 (0.49) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11820322 0.91 NCOA1 (0.53) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11821387 0.91 NCOA1 (0.57) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11816631 0.90 NCOA1 (0.49) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL3893280 0.89 NCOA1 (0.62) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL11828201 0.89 NCOA1 (0.62) NCOA1NCOA3PTGS2ARBRD4
SCHEMBL30731589 0.89 NCOA1 (0.62) NCOA1NCOA3PTGS2ARBRD4

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
JP-5147353-A None JP disclosed
JP-H05147353-A THERMAL RECORDING MATERIAL MITSUI TOATSU CHEM INC 1993-06-15 JP disclosed