SCHEMBL8747751

SCHEMBL8747751

CSc1c(C(=O)c2cnoc2C2CC2)ccc(Cl)c1CN(C)S(C)(=O)=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.31
PDE2A O00408 1/20 0.30
GAA P10253 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
SCHEMBL8747824 0.87 NR1H4 (0.31) NR1H4PDE2AGAA
SCHEMBL8747759 0.85 NR1H4 (0.33) NR1H4PDE2AGAA
SCHEMBL7577256 0.84 DHODH (0.32) PDE2A
SCHEMBL27456386 0.83 GAA (0.33) NR1H4PDE2AGAA
SCHEMBL8492576 0.82 NR1H4 (0.33) NR1H4PDE2A
SCHEMBL7574528 0.82 DHODH (0.31)
SCHEMBL8752743 0.81 DHODH (0.36) PDE2A
SCHEMBL8748151 0.81 F2 (0.34) PDE2AGAA
SCHEMBL8492504 0.81 DHODH (0.35) PDE2A
SCHEMBL8752755 0.80 DHODH (0.32) PDE2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP claimed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO claimed
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP disclosed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO disclosed