SCHEMBL9240668

SCHEMBL9240668

Cn1c(=O)oc2c(C(=O)C(C#N)C(=O)C3CC3)ccc(F)c21

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSC P53634 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
SCHEMBL3061845 0.71 RAB9A (0.36)
SCHEMBL9240551 0.69
SCHEMBL8608727 0.68 NR1I2 (0.39) CTSC
SCHEMBL9116781 0.67
SCHEMBL9241879 0.66 CRACR2A (0.35)
SCHEMBL14155670 0.66 NPC1 (0.38)
SCHEMBL1740206 0.65 F10 (0.37)
SCHEMBL29355315 0.65 F10 (0.37)
SCHEMBL9242243 0.65 MEN1 (0.30)
SCHEMBL3954105 0.65 DHODH (0.37)

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
WO-1995025099-A1 2-CYANO-1,3-DIONE DERIVATIVES USEFUL AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1995-09-21 WO claimed
WO-1995025099-A1 2-CYANO-1,3-DIONE DERIVATIVES USEFUL AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1995-09-21 WO disclosed