SCHEMBL3724838

SCHEMBL3724838

OC[C@H]1OC(Oc2c[nH]c3cccc(Cl)c23)[C@H](O)[C@H]1O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.65
▸ SLC5A2 P31639 18/20 0.62
▸ SLC5A1 P13866 10/20 0.57

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
SCHEMBL3406202 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL3805865 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL31741260 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL3719106 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL2191348 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL7191502 0.99 ATM (0.67) ATMSLC5A2SLC5A1
SCHEMBL3406199 0.87 SLC5A2 (0.49) ATMSLC5A2SLC5A1
SCHEMBL6037243 0.85 ATM (0.58) ATMSLC5A2SLC5A1
SCHEMBL2193732 0.83 SLC5A2 (0.47) ATMSLC5A2SLC5A1
SCHEMBL9238330 0.82 ATM (0.58) ATMSLC5A2SLC5A1

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-2235202-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE Biomérieux (FR) 2010-10-06 — — EP disclosed
WO-2009092982-A2 METHOD FOR DETECTING AND/OR IDENTIFYING CLOSTRIDIUM DIFFICILE bioMérieux (FR) 2009-07-30 — — WO disclosed
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