SCHEMBL10797331

SCHEMBL10797331

COP(C)(=O)Cc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.45
SLC6A4 P31645 6/20 0.43
HTR2A P28223 5/20 0.43
KCNH2 Q12809 5/20 0.43
MEN1 O00255 1/20 0.42
TTR P02766 1/20 0.42
PPOX P50336 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
SCN8A Q9UQD0 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36

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
SCHEMBL10482233 0.81 FFAR1 (0.50) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10946797 0.78 FFAR1 (0.47) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10797339 0.78 FFAR1 (0.47) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10516125 0.76 FFAR1 (0.70) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10691494 0.76 FFAR1 (0.49) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10950203 0.76 FFAR1 (0.44) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10851043 0.75 FFAR1 (0.47) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL11150594 0.74 FFAR1 (0.48) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL10943649 0.73 AR (0.43) FFAR1SLC6A4HTR2AKCNH2MEN1
SCHEMBL11848309 0.73 TDP1 (0.55) FFAR1SLC6A4HTR2AKCNH2MEN1

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-4714491-A PRE- AND POSTEMERGENCE STAUFFER CHEMICAL COMPANY (US) 1987-12-22 US disclosed