SCHEMBL9518677

SCHEMBL9518677

COc1cc(-c2c[nH]c(C#N)c2C(F)(F)F)ccc1C#N

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 15/20 0.49
PGR P06401 4/20 0.49
CHEK1 O14757 1/20 0.42
SLC22A12 Q96S37 1/20 0.40
KIT P10721 1/20 0.38

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
SCHEMBL9518694 0.73 LRRK2 (0.40) AR
SCHEMBL9951140 0.73 AR (0.56) ARPGRCHEK1
SCHEMBL31537634 0.72 AR (0.44) ARPGRCHEK1SLC22A12
SCHEMBL5656320 0.69 AR (0.50) ARPGR
SCHEMBL2526268 0.69 AR (0.53) ARPGR
SCHEMBL1666515 0.68 BRD4 (0.66) ARPGRKIT
SCHEMBL34472219 0.68 AR (0.55) ARPGRCHEK1
SCHEMBL19614570 0.66 AR (0.54) ARPGR
SCHEMBL7629786 0.66 AR (0.56) ARPGRCHEK1KIT
SCHEMBL16158532 0.65 AR (0.52) ARPGRCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0312723-B1 Method of and bait compositions for controlling mollusks AMERICAN CYANAMID CO (US) 1993-12-22 EP disclosed
US-5010098-A Arylpyrrole insecticidal acaricidal and nematicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1991-04-23 US disclosed
US-4929634-A ARYLPYRROLE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1990-05-29 US 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
EP-0312723-A2 Method of and bait compositions for controlling mollusks AMERICAN CYANAMID COMPANY (US) 1989-04-26 EP disclosed