SCHEMBL8396390

SCHEMBL8396390

CSc1ccccc1N(Cc1nc2cc(F)cc(F)c2s1)C(=O)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 10/20 0.42
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL8397843 0.89 SMN1; SMN2 (0.37) AKR1B1GAAMEN1KMT2A
SCHEMBL8399645 0.88 AKR1B1 (0.46) AKR1B1GAALMNA
SCHEMBL8395897 0.88 AKR1B1 (0.44) AKR1B1GAALMNAMEN1KMT2A
SCHEMBL8399154 0.86 AKR1B1 (0.35) AKR1B1GAALMNAMEN1KMT2A
SCHEMBL8398163 0.86 AKR1B1 (0.44) AKR1B1GAALMNA
SCHEMBL8400555 0.86 AKR1B1 (0.44) AKR1B1GAALMNA
SCHEMBL8398844 0.85 AKR1B1 (0.42) AKR1B1GAAKMT2A
SCHEMBL8396464 0.85 AKR1A1 (0.46) AKR1B1
SCHEMBL8397936 0.84 AKR1B1 (0.48) AKR1B1GAALMNA
SCHEMBL8400507 0.83 AKR1B1 (0.40) AKR1B1GAALMNA

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 2 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