SCHEMBL9696367

SCHEMBL9696367

CC(=O)Oc1cc(-c2nn(C)c(S(C)(=O)=O)c2Cl)c(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
GFER P55789 1/20 0.31
TNFSF11 O14788 1/20 0.30
PTGS2 P35354 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
SCHEMBL9696394 0.89 RORC (0.31) KDM4EGLAGAAGFER
SCHEMBL9530563 0.86 PTGS2 (0.39) KDM4EPTGS2
SCHEMBL9534173 0.84 PTGDR2 (0.39) KDM4E
SCHEMBL9530862 0.83 PPOX (0.35) PTGS2
SCHEMBL9529358 0.83 KDM4E (0.35) KDM4E
SCHEMBL6909705 0.82 BACE1 (0.35) KDM4EGLAGAAGFERTNFSF11
SCHEMBL9530417 0.81 RORC (0.31)
SCHEMBL9696140 0.81 LMNA (0.34) KDM4EGAA
SCHEMBL7590435 0.81 LMNA (0.38)
SCHEMBL7972198 0.81 NTRK1 (0.34)

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-1992002509-A1 HERBICIDAL SUBSTITUTED ARYL ALKYLSULFONYL PYRAZOLES MONSANTO COMPANY (US) 1992-02-20 WO claimed
WO-1992002509-A1 HERBICIDAL SUBSTITUTED ARYL ALKYLSULFONYL PYRAZOLES MONSANTO COMPANY (US) 1992-02-20 WO disclosed