SCHEMBL9015548

SCHEMBL9015548

CCN(CC)C(=O)n1cnc(S(=O)(=O)c2c(C)nn(CC(F)(F)F)c2Cl)n1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 1/20 0.31
DPP4 P27487 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
P2RX7 Q99572 1/20 0.30

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
SCHEMBL9015560 0.88 DPP4 (0.33) DPP4NPSR1
SCHEMBL9015525 0.79 NPSR1 (0.34) DPP4NPSR1
SCHEMBL9368251 0.78 P2RX7 (0.32) FPR1NPSR1P2RX7
SCHEMBL9015546 0.78 DPP4 (0.33) DPP4NPSR1
SCHEMBL9378261 0.73 DPP4 (0.36) DPP4NPSR1P2RX7
Cafenstrole SCHEMBL54625 0.73 KMT2A (0.49) DPP4
SCHEMBL9015559 0.73 ALDH1A1 (0.39) DPP4NPSR1
SCHEMBL3786924 0.72 HTR6 (0.50)
SCHEMBL7657807 0.71 DPP4 (0.38) DPP4NPSR1P2RX7
SCHEMBL3788531 0.71 HTR6 (0.38) DPP4

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-5510320-A EXCELLENT CONTROL OF BLACKGRASS AND WILD OATS AND OTHER WEEDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US disclosed
WO-1993009100-A1 HERBICIDAL TRIAZOLECARBOXAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-05-13 WO disclosed