SCHEMBL7795900

SCHEMBL7795900

CCOC(=O)c1ccc2nc(S)[nH]c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 1/20 0.64
PKN2 Q16513 1/20 0.64
SIRT2 Q8IXJ6 6/20 0.62
SIRT1 Q96EB6 5/20 0.62
SIRT3 Q9NTG7 2/20 0.62
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 4/20 0.50
HCRTR1 O43613 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MAPT P10636 3/20 0.49
RAB9A P51151 3/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PPARG P37231 1/20 0.48
NCOA2 Q15596 1/20 0.48
NCOA1 Q15788 1/20 0.48
MAPK1 P28482 2/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL7795891 0.89 HCRTR1 (0.53) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL9306377 0.87 PKN1 (0.50) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL6169071 0.86 PKN1 (0.67) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL8248442 0.84 PKN1 (0.65) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL6217370 0.84 HTT (0.64) PKN1PKN2ALDH1A1KDM4EHPGD
SCHEMBL8294924 0.83 PKN1 (0.64) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL8283877 0.83 PKN1 (0.64) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL8284384 0.83 SIRT2 (0.70) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL14473810 0.82 PKN1 (0.62) PKN1PKN2SIRT2SIRT1SIRT3
SCHEMBL12855143 0.81 PKN1 (0.61) PKN1PKN2SIRT2SIRT1SIRT3

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742210-B1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2001-11-21 EP disclosed
US-6288236-B1 PREVENTIVE AND THERAPEUTIC MEDICAMENT FOR HYPERLIPEMIA OR ARTERIAL SCLEROSIS. FUJI PHOTO FILM CO., LTD. (JP) 2001-09-11 US disclosed
WO-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed
US-6174907-B1 THERAPY AND PROPHYLAXIS OF HYPERLIPEMIA OR ARTERIAL SCLEROSIS; AS ADDITIVE OF A SILVER HALIDE PHOTOSENSITIVE MATERIAL, LIQUID CRYSTAL MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 2001-01-16 US disclosed
US-5998456-A ANTILIPEMIC AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1999-12-07 US disclosed
US-5962493-A HYPOLIPEMIC AGENTS; ANTICHOLESTEROL AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1999-10-05 US disclosed
EP-0849259-A1 BENZIMIDAZOLE COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 1998-06-24 EP disclosed
EP-0742210-A1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 1996-11-13 EP disclosed
EP-0287971-B1 BENZIMIDAZOLE DERIVATIVES AND PROCESS FOR THEIR PREPARATIONS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1993-02-24 EP disclosed
US-4942245-A ANTIALLERGIC AGENTS, ANTIASTHMATICS, RHINITIS, CONJUNCTIVITIS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-07-17 US disclosed
EP-0287971-A2 Benzimidazole derivatives and process for their preparations KYORIN PHARMACEUTICAL CO., LTD. (JP) 1988-10-26 EP disclosed