SCHEMBL18405152

SCHEMBL18405152

Cc1ccccc1Cn1nc(-c2ncc(S(C)(=O)=O)c(O)n2)cc1-c1ccon1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GUCY1B2 O75343 20/20 0.56
▸ GUCY1A2 P33402 20/20 0.56
▸ GUCY1A1 Q02108 20/20 0.56
▸ GUCY1B1 Q02153 20/20 0.56
▸ OPRK1 P41145 1/20 0.49
▸ CYP2C9 P11712 1/20 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
SCHEMBL10330235 0.90 GUCY1B2 (0.69) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL18405134 0.84 GUCY1B2 (0.57) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL10324712 0.82 GUCY1B2 (0.66) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL18404849 0.81 GUCY1B2 (0.61) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL3437398 0.80 GUCY1B2 (0.70) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL18405244 0.80 GUCY1B2 (0.72) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL10330221 0.80 GUCY1B2 (0.77) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL10330251 0.79 GUCY1B2 (0.64) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL10330237 0.79 GUCY1B2 (0.61) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1
SCHEMBL15087451 0.79 GUCY1B2 (0.67) GUCY1B2GUCY1A2GUCY1A1GUCY1B1OPRK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588465-B1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS INC (US) 2017-01-25 — — EP disclosed
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