SCHEMBL7679356

SCHEMBL7679356

O=C(O)CC(NS(=O)(=O)c1cccc2cccnc12)C(=O)Cn1nnc(Cc2c(Cl)cccc2Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NTSR1 P30989 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
FABP1 P07148 2/20 0.38
MMP2 P08253 1/20 0.37
SLC2A1 P11166 1/20 0.37
TSHR P16473 2/20 0.37
HTT P42858 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGAV P06756 1/20 0.37
PKLR P30613 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL7680008 0.88 ITGAV (0.43) MMP2HTTITGAVALDH1A1HPGD
SCHEMBL7682355 0.88 CASP1 (0.40) NTSR1TSHRITGB3ITGAV
SCHEMBL7684007 0.86 CASP1 (0.45) MAPTITGAVALDH1A1HPGD
SCHEMBL7677159 0.85 CASP1 (0.41) PTGDR2ITGB3ITGAVHPGD
SCHEMBL7687226 0.85 ALDH1A1 (0.39) MAPTPTGDR2MEN1KMT2AITGAV
SCHEMBL7679385 0.85 POLB (0.39) MAPTMMP2ITGAVHPGD
SCHEMBL7676718 0.85 ALDH1A1 (0.38) MAPTMEN1KMT2ATSHRHTT
SCHEMBL7681962 0.85 ALDH1A1 (0.47) GAAMAPTMEN1KMT2ACYP1A2
SCHEMBL7678024 0.84 CNR2 (0.40) NPSR1MMP2ITGB3ITGAVALDH1A1
SCHEMBL7686355 0.83 MMP9 (0.44) MMP2

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