SCHEMBL7368425

SCHEMBL7368425

Cc1csc(C(=O)c2cc(C)cs2)c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.71
CASP3 P42574 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 1/20 0.39
GSK3B P49841 3/20 0.38
KDR P35968 3/20 0.38
HCAR3 P49019 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
KDM5A P29375 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
SCHEMBL5859674 0.85 DAO (0.71) DAOCASP3SENP7SENP8SENP6
SCHEMBL1612962 0.83
SCHEMBL130041 0.83
SCHEMBL279422 0.81
SCHEMBL1786459 0.81
SCHEMBL3428971 0.81
Hydrochloric Acid SCHEMBL11533312 0.81 DAO (0.95) DAOCASP3SENP7SENP8SENP6
SCHEMBL10821342 0.80 DAO (0.53) DAOMAPTALDH1A1LMNA
SCHEMBL24322069 0.79 DAO (0.63) DAOCASP3SENP7SENP8SENP6
SCHEMBL15979699 0.79 DAO (0.63) DAOCASP3SENP7SENP8SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5137889-A Hypotensive agents; coronary vasodilators; calcium antagonists; antiinflammatory agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-08-11 US disclosed
US-5034395-A Hypotensive agents, carboxylated dihydropyridines OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0145434-A2 Novel dihydropyridine derivatives and process for preparing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-06-19 EP disclosed