SCHEMBL8891685

SCHEMBL8891685

CS(=O)(=O)c1ccc(C(=O)c2cnoc2C2CC2)c(Cc2ccc(Cl)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.38
PTGS1 P23219 2/20 0.38
TBXA2R P21731 5/20 0.36
PTGDR Q13258 5/20 0.36
CCR1 P32246 1/20 0.35
PTGER2 P43116 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33
F10 P00742 2/20 0.33
MAPK1 P28482 1/20 0.33
CCR3 P51677 1/20 0.33

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
SCHEMBL8892121 0.91 TBXA2R (0.36) TBXA2RPTGDRMAPK1
SCHEMBL8890658 0.90 PTGS2 (0.40) PTGS2PTGS1MEN1KMT2APOLB
SCHEMBL8894099 0.87 PTGS2 (0.40) PTGS2MEN1KMT2APOLB
SCHEMBL8495014 0.86 DHODH (0.34) PTGS2PTGS1MEN1KMT2A
SCHEMBL8890712 0.85 KDM4E (0.34) PTGS2PTGS1
SCHEMBL8892962 0.85 CA1 (0.39) PTGS2PTGS1
SCHEMBL7573465 0.84 DHODH (0.33) MEN1KMT2AMAPK1
SCHEMBL8893425 0.84 KDM4E (0.33) MEN1KMT2A
SCHEMBL8818332 0.83 DHODH (0.30)
SCHEMBL8892612 0.83 TBXA2R (0.36) TBXA2RMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed