SCHEMBL7686366

SCHEMBL7686366

O=C(O)CC(NS(=O)(=O)c1ccc(N2CCOCC2)cc1)C(=O)Cn1nnnc1Cc1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
AIMP2 Q13155 1/20 0.39
S1PR1 P21453 1/20 0.38
MMP2 P08253 3/20 0.38
MMP13 P45452 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MMP3 P08254 2/20 0.38
GLA P06280 1/20 0.38
MMP1 P03956 1/20 0.37
KMT2A Q03164 1/20 0.37
AURKA O14965 1/20 0.35
KDR P35968 1/20 0.35
FLT3 P36888 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
ADAMTS7 Q9UKP4 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.35
ACP1 P24666 1/20 0.35

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
SCHEMBL7681872 0.94 ALDH1A1 (0.37) MAPTHTTMMP2MMP13ALDH1A1
SCHEMBL7684963 0.88 ALDH1A1 (0.37) MMP2MMP13ALDH1A1ITGB3ADAMTS5
SCHEMBL7682657 0.85 LMNA (0.38) MAPTS1PR1MMP2ALDH1A1ADAMTS5
SCHEMBL7679508 0.84 MMP13 (0.38) MMP2MMP13ALDH1A1ADAMTS5
SCHEMBL7680377 0.84 ALDH1A1 (0.42) MAPTALDH1A1KDR
SCHEMBL7684335 0.84 SMN1; SMN2 (0.42) POLBMAPTHTTMMP2MMP13
SCHEMBL7680120 0.82 S1PR1 (0.39) S1PR1ALDH1A1
SCHEMBL7684936 0.81 MMP13 (0.43) MAPTHTTS1PR1MMP2MMP13
SCHEMBL7683248 0.79 ALDH1A1 (0.39) POLBMAPTALDH1A1
SCHEMBL7679510 0.76 TRPV1 (0.34) MAPTMMP2

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-6376484-B1 FOR PREVENTION AND/OR TREATMENT OF VARIOUS KINDS OF INFLAMMATORY DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-23 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