SCHEMBL8072565

SCHEMBL8072565

CCOCn1c(Cl)c(Cl)c(C#N)c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.36
ADORA1 P30542 1/20 0.35
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
RXFP1 Q9HBX9 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NAAA Q02083 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPK14 Q16539 1/20 0.31
DHODH Q02127 1/20 0.30

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
SCHEMBL9388094 0.91
SCHEMBL5819960 0.89 KIF11 (0.35) KIF11ADORA1CTSSCTSKRXFP1
SCHEMBL9567369 0.86 KIF11 (0.33) KIF11ADORA1CTSSCTSKRXFP1
SCHEMBL10590618 0.86 KDM4E (0.36) RXFP1ALDH1A1MAPT
SCHEMBL10592455 0.86 ADORA1 (0.39) ADORA1ALDH1A1DHODH
SCHEMBL9222722 0.83 ADORA1 (0.35) KIF11ADORA1RXFP1NPC1RAB9A
SCHEMBL9840560 0.82 KIF11 (0.37) KIF11ADORA1CTSSCTSKNAAA
SCHEMBL9058461 0.81 ADORA1 (0.43) KIF11ADORA1CTSSCTSKRXFP1
SCHEMBL9059293 0.81 KIF11 (0.41) KIF11ADORA1CTSSCTSKRXFP1
SCHEMBL5812558 0.81 RXFP1 (0.36) RXFP1ALDH1A1MAPT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0347488-B1 Arylpyrrole insecticidal acaricidal and nematicidal agents and method for the preparation thereof AMERICAN CYANAMID CO (US) 1994-06-01 EP claimed
EP-0347488-A1 Arylpyrrole insecticidal acaricidal and nematicidal agents and method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1989-12-27 EP claimed
EP-0642303-B1 SUBSTITUTED 2-ARYLPYRROLES BAYER AG (DE) 2000-08-02 EP disclosed
US-5521211-A INSECTICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
EP-0642303-A1 SUBSTITUTED 2-ARYLPYRROLES BAYER AG (DE) 1995-03-15 EP disclosed
WO-1993024484-A1 SUBSTITUTED 2-ARYLPYRROLES BAYER AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
WO-1993024001-A1 SUBSTITUTED 2-ARYLPYRROLES BAYER AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
EP-0347488-A1 Arylpyrrole insecticidal acaricidal and nematicidal agents and method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1989-12-27 EP disclosed