SCHEMBL18405171

SCHEMBL18405171

C=C/C=C(Cn1nc(-c2ncc(C)c(O)n2)cc1-c1ncco1)\C(F)=C/C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GUCY1B2 O75343 1/20 0.33
▸ GUCY1A2 P33402 1/20 0.33
▸ GUCY1A1 Q02108 1/20 0.33
▸ GUCY1B1 Q02153 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
SCHEMBL10269509 0.66 GUCY1B2 (0.65) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18899199 0.66 GUCY1B2 (0.51) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18899189 0.65 — —
SCHEMBL3437542 0.63 GUCY1B2 (0.56) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL15069068 0.61 GUCY1B2 (0.54) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL16202158 0.60 GUCY1B2 (0.55) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18404986 0.60 GUCY1B2 (0.52) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL18405244 0.59 GUCY1B2 (0.72) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL3437521 0.59 GUCY1B2 (0.53) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL16058247 0.59 GUCY1B2 (0.65) 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 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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