SCHEMBL7679508

SCHEMBL7679508

O=C(O)CC(NS(=O)(=O)c1ccc(Sc2ccccc2)cc1)C(=O)Cn1nnnc1Cc1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 3/20 0.38
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
MMP2 P08253 4/20 0.34
ADAMTS5 Q9UNA0 1/20 0.34
ADAMTS4 O75173 2/20 0.34
DOT1L Q8TEK3 1/20 0.34
MMP9 P14780 4/20 0.33
MMP8 P22894 2/20 0.33
MMP12 P39900 1/20 0.33
MMP14 P50281 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
TRPV1 Q8NER1 1/20 0.32

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
SCHEMBL7684963 0.92 ALDH1A1 (0.37) MMP13LMNANPSR1ALDH1A1RECQL
SCHEMBL7682657 0.88 LMNA (0.38) LMNANPSR1ALDH1A1RECQLMMP2
SCHEMBL7680377 0.87 ALDH1A1 (0.42) LMNANPSR1ALDH1A1RECQLADAMTS4
SCHEMBL7684335 0.87 SMN1; SMN2 (0.42) MMP13LMNANPSR1ALDH1A1RECQL
SCHEMBL7681872 0.85 ALDH1A1 (0.37) MMP13LMNANPSR1ALDH1A1RECQL
SCHEMBL7680120 0.85 S1PR1 (0.39) LMNANPSR1ALDH1A1RECQL
SCHEMBL7686874 0.84 MMP13 (0.39) MMP13LMNANPSR1ALDH1A1RECQL
SCHEMBL7684936 0.84 MMP13 (0.43) MMP13LMNANPSR1ALDH1A1RECQL
SCHEMBL7686366 0.84 POLB (0.40) MMP13ALDH1A1MMP2ADAMTS5
SCHEMBL7683248 0.83 ALDH1A1 (0.39) ALDH1A1DOT1LKDM4CTRPV1

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