SCHEMBL2652927

SCHEMBL2652927

CS(=O)(=O)c1ccc(C2[CH]CCC2)cc1S(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALDH1A1 P00352 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
SCHEMBL2645542 0.86 GCK (0.33) L3MBTL1
SCHEMBL2645256 0.86 TSHR (0.33) L3MBTL1
SCHEMBL2645512 0.83 PIK3CD (0.34) L3MBTL1
SCHEMBL4427570 0.66 KDM4E (0.47) —
SCHEMBL8331366 0.65 RXRA (0.40) —
SCHEMBL6831259 0.64 ESR2 (0.42) —
SCHEMBL1878862 0.64 HTR3A (0.42) —
SCHEMBL2646076 0.63 CYP19A1 (0.41) ALDH1A1
SCHEMBL20092549 0.63 TYK2 (0.41) L3MBTL1ALDH1A1
SCHEMBL779656 0.63 ALDH1A1 (0.38) ALDH1A1

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-1169312-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-09 — — EP disclosed
WO-2000058293-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2000-10-05 — — WO disclosed
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