SCHEMBL6507979

SCHEMBL6507979

CNC1SCN(c2cccc(OC(F)(F)F)c2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.43
DRD3 P35462 3/20 0.43
KCNH2 Q12809 3/20 0.43
OPRL1 P41146 1/20 0.41
NOTUM Q6P988 1/20 0.41
CARM1 Q86X55 3/20 0.40
PRMT6 Q96LA8 3/20 0.40
MCHR1 Q99705 1/20 0.39
PIM1 P11309 2/20 0.39
HCRTR1 O43613 3/20 0.39
HCRTR2 O43614 2/20 0.39
ROCK2 O75116 2/20 0.38
MLYCD O95822 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
DHFR P00374 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
METAP2 P50579 1/20 0.37

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
SCHEMBL8552157 0.82 DRD2 (0.44) DRD2DRD3KCNH2OPRL1NOTUM
SCHEMBL6508550 0.82 CA12 (0.43) DRD2DRD3
SCHEMBL8089666 0.82 DRD2 (0.44) DRD2DRD3KCNH2OPRL1NOTUM
SCHEMBL8103660 0.82 NOTUM (0.45) DRD2DRD3KCNH2OPRL1NOTUM
SCHEMBL8662424 0.80 MCHR1 (0.39) DRD2DRD3KCNH2NOTUMMCHR1
SCHEMBL8662419 0.80 MCHR1 (0.39) DRD2DRD3KCNH2OPRL1NOTUM
SCHEMBL6508393 0.79 TRPA1 (0.34) HCRTR1HCRTR2
SCHEMBL27509180 0.79 GCGR (0.39) DRD2DRD3KCNH2NOTUMMCHR1
SCHEMBL7608380 0.78 ROCK2 (0.53) DRD2DRD3KCNH2OPRL1NOTUM
SCHEMBL7604788 0.78 ROCK2 (0.53) DRD2DRD3KCNH2OPRL1NOTUM

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
WO-2005000824-A1 LAZOLIDINE DERIVATIVES AS HERBICIDAL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-01-06 WO disclosed