SCHEMBL8400510

SCHEMBL8400510

Cc1csc(N(Cc2nc3cc(F)cc(F)c3s2)C(=O)CCC(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 8/20 0.43
GAA P10253 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL8399299 0.90 AKR1B1 (0.37) AKR1B1LMNA
SCHEMBL8399620 0.88 AKR1B1 (0.39) AKR1B1GAALMNA
SCHEMBL8399211 0.85 AKR1B1 (0.33) AKR1B1
SCHEMBL8396039 0.84 AKR1A1 (0.42) AKR1B1
SCHEMBL8399244 0.84 AKR1B1 (0.44) AKR1B1GAA
SCHEMBL8397923 0.82 AKR1B1 (0.42) AKR1B1LMNA
SCHEMBL8396394 0.82 AKR1B1 (0.42) AKR1B1GAALMNA
SCHEMBL8398697 0.82 AKR1B1 (0.42) AKR1B1GAALMNA
SCHEMBL8399645 0.81 AKR1B1 (0.46) AKR1B1GAALMNA
SCHEMBL8399128 0.81 AKR1B1 (0.43) AKR1B1LMNA

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
EP-0647636-B1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF SENJU PHARMA CO (JP) 1999-06-09 EP disclosed
US-5532257-A ENZYME INHIBITOR SENJU PHARMACEUTICAL CO., LTD (JP) 1996-07-02 US disclosed
EP-0647636-A1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Senju Pharmaceutical Co., Ltd. (JP) 1995-04-12 EP disclosed