SCHEMBL3229753

SCHEMBL3229753

Cc1ccc(OCc2ccc(B3OC(C)(C)C(C)(C)O3)cc2C)c(-c2csc(N3CCC(C(=O)O)CC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GUCY1B2 O75343 20/20 0.47
GUCY1A2 P33402 20/20 0.47
GUCY1A1 Q02108 20/20 0.47
GUCY1B1 Q02153 20/20 0.47

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
SCHEMBL3234865 0.92 GUCY1B2 (0.44) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL19110961 0.89 GUCY1B2 (0.54) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL3998970 0.87 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL3230736 0.84 GUCY1B2 (0.50) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709400 0.83 SMN1; SMN2 (0.50) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709303 0.82 GUCY1B2 (0.48) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709443 0.81 GUCY1B2 (0.49) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709823 0.81 GUCY1B2 (0.48) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709572 0.81 GUCY1B2 (0.53) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL14709595 0.81 GUCY1B2 (0.50) GUCY1B2GUCY1A2GUCY1A1GUCY1B1

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
WO-2010015652-A2 THIAZOLE COMPOUNDS AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE SMITHKLINE BEECHAM CORPORATION (US) 2010-02-11 WO disclosed
WO-2010015652-A2 THIAZOLE COMPOUNDS AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE SMITHKLINE BEECHAM CORPORATION (US) 2010-02-11 WO disclosed