SCHEMBL7683710

SCHEMBL7683710

O=C(O)CC(NS(=O)(=O)c1cccc(-c2ccccc2)c1)C(=O)Cn1nnc(Cc2c(Cl)cccc2Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 8/20 0.42
ITGAV P06756 8/20 0.42
CNR2 P34972 2/20 0.39
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
ADAMTS4 O75173 2/20 0.38
MMP13 P45452 1/20 0.38
MMP2 P08253 2/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
MMP12 P39900 1/20 0.37
MMP14 P50281 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
LARS1 Q9P2J5 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
SCHEMBL7678024 0.95 CNR2 (0.40) ITGB3ITGAVCNR2MMP9MMP8
SCHEMBL7686355 0.94 MMP9 (0.44) CNR2MMP9MMP8ADAMTS4MMP13
SCHEMBL7686810 0.93 SLC1A3 (0.41) ITGB3ITGAVCNR2MMP9MMP2
SCHEMBL7687017 0.92 MMP2 (0.39) CNR2MMP9MMP8ADAMTS4MMP13
SCHEMBL7686196 0.91 MMP2 (0.38) ITGB3ITGAVCNR2MMP9MMP13
SCHEMBL7680110 0.91 ITGB3 (0.37) ITGB3ITGAVCNR2MMP9ADAMTS4
SCHEMBL7687013 0.91 SLC1A3 (0.39) CNR2MMP9MMP8ADAMTS4MMP13
SCHEMBL7683595 0.90 MMP2 (0.44) MMP9MMP8ADAMTS4MMP13MMP2
SCHEMBL7686108 0.89 MMP2 (0.42) MMP9MMP8ADAMTS4MMP13MMP2
SCHEMBL7682261 0.89 ALDH1A1 (0.37) CNR2MMP9MMP8ADAMTS4MMP13

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