SCHEMBL7693284

SCHEMBL7693284

Cc1c(-c2cc(O)c(Cl)cc2Cl)nn(C)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.33
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HSP90AA1 P07900 2/20 0.31
HSP90AB1 P08238 1/20 0.31
DRD2 P14416 1/20 0.31
DRD1 P21728 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31

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
SCHEMBL7687809 0.88 AR (0.33) AR
SCHEMBL7694251 0.83 HSP90AA1 (0.31) HSP90AA1HSP90AB1
SCHEMBL7689395 0.83 HSP90AA1 (0.31) ARHSP90AA1HSP90AB1
SCHEMBL7686734 0.81 HSP90AB1 (0.49) HSP90AA1HSP90AB1
SCHEMBL7811612 0.76 AR (0.34) AR
SCHEMBL7694982 0.75 PGK1 (0.40) HSP90AA1HSP90AB1DRD1
SCHEMBL7968440 0.74
SCHEMBL7686737 0.72 PDE10A (0.30)
SCHEMBL7688339 0.72 LMNA (0.32)
SCHEMBL7690605 0.71 HSD11B1 (0.39)

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
US-6339046-B1 FOR CONTROLLING WEEDS SYNGENTA INVESTMENT CORPORATION 2002-01-15 US disclosed
EP-0839808-A1 Pyrazole derivatives, processes for their preparation, and their use as herbicides Novartis AG (CH) 1998-05-06 EP disclosed