SCHEMBL7684963

SCHEMBL7684963

O=C(O)CC(NS(=O)(=O)c1ccccc1)C(=O)Cn1nnnc1Cc1c(Cl)cccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
DOT1L Q8TEK3 1/20 0.37
KDM4C Q9H3R0 1/20 0.36
MMP2 P08253 2/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
ADAMTS4 O75173 2/20 0.35
ITGAV P06756 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
ITGB3 P05106 1/20 0.35
EEF2K O00418 1/20 0.34
MMP9 P14780 2/20 0.34
MMP8 P22894 2/20 0.34
MMP13 P45452 1/20 0.34
MMP12 P39900 1/20 0.34
MMP14 P50281 1/20 0.34
CASP1 P29466 1/20 0.33
CASP3 P42574 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
SCHEMBL7679508 0.92 MMP13 (0.38) ALDH1A1LMNARECQLNPSR1DOT1L
SCHEMBL7682657 0.92 LMNA (0.38) ALDH1A1LMNARECQLNPSR1DOT1L
SCHEMBL7680377 0.90 ALDH1A1 (0.42) ALDH1A1LMNARECQLNPSR1ADAMTS4
SCHEMBL7684335 0.90 SMN1; SMN2 (0.42) ALDH1A1LMNARECQLNPSR1DOT1L
SCHEMBL7681872 0.89 ALDH1A1 (0.37) ALDH1A1LMNARECQLNPSR1MMP2
SCHEMBL7683248 0.88 ALDH1A1 (0.39) ALDH1A1DOT1LKDM4CITGAVTRPV1
SCHEMBL7680120 0.88 S1PR1 (0.39) ALDH1A1LMNARECQLNPSR1
SCHEMBL7684936 0.88 MMP13 (0.43) ALDH1A1LMNARECQLNPSR1KDM4C
SCHEMBL7686366 0.88 POLB (0.40) ALDH1A1MMP2ADAMTS5ITGB3MMP13
SCHEMBL7679510 0.85 TRPV1 (0.34) DOT1LKDM4CMMP2TRPV1MMP9

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 4 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
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