SCHEMBL8748147

SCHEMBL8748147

CN(Cc1c(C(=O)c2cnoc2C2CC2)ccc(F)c1F)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.33
BRAF P15056 1/20 0.33
NR1H4 Q96RI1 7/20 0.32
TACR3 P29371 2/20 0.32
PDE2A O00408 1/20 0.32
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
CRACR2A Q9BSW2 1/20 0.31
STAT3 P40763 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
MAPK1 P28482 2/20 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
SCHEMBL8747759 0.90 NR1H4 (0.33) DHODHNR1H4TACR3PDE2A
SCHEMBL8747750 0.84 DPP4 (0.35) DHODHTACR3PDE2ATRPV1
SCHEMBL7559214 0.83 DHODH (0.34) DHODHBRAFPDE2ACRACR2A
SCHEMBL8748151 0.82 F2 (0.34) DHODHPDE2A
SCHEMBL8747745 0.81 DHODH (0.43) DHODHTRPV1
SCHEMBL7558771 0.81 BRAF (0.33) DHODHBRAFCRACR2ATRPV1
SCHEMBL8491101 0.81 DHODH (0.37) DHODHPDE2ACRACR2AMAPK1
SCHEMBL8747841 0.80 PDE2A (0.32) DHODHPDE2ATRPV1
SCHEMBL9115628 0.80 DHODH (0.35) DHODHNR1H4PDE2ACRACR2A
SCHEMBL8747888 0.80 KDM4E (0.37) DHODHNR1H4TACR3PDE2AMAPK1

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