SCHEMBL9224359

SCHEMBL9224359

C#CCN1C(=O)COc2cc(F)c(NC(C)=O)cc21

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
CHRM1 P11229 1/20 0.41
PLK1 P53350 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 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
SCHEMBL9031064 0.89 POLB (0.44) POLBCHRM1PLK1TSHRHTT
SCHEMBL9228447 0.87 POLB (0.44) POLBCHRM1PLK1TSHRMAPT
SCHEMBL9727365 0.86 POLB (0.44) POLBCHRM1PLK1TSHRHTT
SCHEMBL7687650 0.86 CHRM1 (0.40) POLBCHRM1TSHR
SCHEMBL4683567 0.84 CHRM1 (0.37) POLBCHRM1PLK1TSHRHTT
SCHEMBL6831854 0.83 POLB (0.38) POLBCHRM1PLK1TSHRHTT
SCHEMBL12654920 0.83 POLB (0.38) POLBCHRM1PLK1TSHRHTT
SCHEMBL9345399 0.81 POLB (0.37) POLBCHRM1PLK1
SCHEMBL4679070 0.81 CHRM1 (0.36) POLBCHRM1PLK1TSHRHTT
SCHEMBL303837 0.81 POLB (0.36) POLBCHRM1

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-5468719-A N-acyl-n-phenyltetrahydrophthalamic acid derivatives, methods of producing same, and herbicides containing same as effective components CENTRAL GLASS COMPANY, LIMITED (JP) 1995-11-21 US disclosed
EP-0600089-A1 N-ACYL-N-PHENYLTETRAHYDROPHTHALAMIC ACID DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT CENTRAL GLASS COMPANY, LIMITED (JP) 1994-06-08 EP disclosed