SCHEMBL22779529

SCHEMBL22779529

CCS(=O)(=O)c1ccc(-n2cncn2)nc1-c1nc2cc(C(C)(F)F)n(C3CC3)c(=O)c2n1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
DDR1 Q08345 10/20 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
SCHEMBL22349505 0.95 CNR2 (0.32) CNR2DDR1
SCHEMBL18357977 0.84 DDR1 (0.33) DDR1
SCHEMBL20104428 0.83 DDR1 (0.30) DDR1
SCHEMBL18357950 0.80 CNR2 (0.35) CNR2DDR1
SCHEMBL21805952 0.79 HSD17B10 (0.33) DDR1
SCHEMBL20505494 0.79 CNR2 (0.35) CNR2DDR1
SCHEMBL21805954 0.79 HSD17B10 (0.34)
SCHEMBL20581683 0.77 CNR2 (0.34) CNR2DDR1
SCHEMBL20581675 0.77 CNR2 (0.34) CNR2
SCHEMBL20581786 0.77 CNR2 (0.34) CNR2DDR1

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
EP-3317276-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-12-16 EP disclosed