SCHEMBL7682575

SCHEMBL7682575

COc1ccccc1S(=O)(=O)NC(CC(=O)O)C(=O)Cn1nnc(Cc2c(Cl)cccc2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 13/20 0.43
CNR2 P34972 2/20 0.41
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
ITGB3 P05106 11/20 0.37
DOT1L Q8TEK3 1/20 0.37

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
SCHEMBL7682055 0.91 CASP1 (0.41) CNR2MAPTL3MBTL1DOT1L
SCHEMBL7680008 0.91 ITGAV (0.43) ITGAVCNR2L3MBTL1DOT1L
SCHEMBL7677159 0.89 CASP1 (0.41) ITGAVCNR2L3MBTL1ITGB3
SCHEMBL7684007 0.88 CASP1 (0.45) ITGAVCNR2MAPTSMN1; SMN2L3MBTL1
SCHEMBL7679385 0.87 POLB (0.39) ITGAVCNR2MAPTL3MBTL1DOT1L
SCHEMBL7687226 0.87 ALDH1A1 (0.39) ITGAVCNR2MEN1MAPTKMT2A
SCHEMBL7678024 0.87 CNR2 (0.40) ITGAVCNR2LMNAITGB3
SCHEMBL7684039 0.87 MMP2 (0.42) CNR2MEN1LMNAMAPTKMT2A
SCHEMBL7682355 0.87 CASP1 (0.40) ITGAVCNR2ITGB3
SCHEMBL7686355 0.85 MMP9 (0.44) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US claimed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP claimed
US-6376484-B1 FOR PREVENTION AND/OR TREATMENT OF VARIOUS KINDS OF INFLAMMATORY DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-23 US disclosed
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed