SCHEMBL23787907

SCHEMBL23787907

CC(=O)c1cc(-c2ncc(F)c(NC[C@@H](CC(=O)O)C(C)C)n2)nn1Cc1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GUCY1B2 O75343 19/20 0.46
▸ GUCY1A2 P33402 19/20 0.46
▸ GUCY1A1 Q02108 19/20 0.46
▸ GUCY1B1 Q02153 19/20 0.46
▸ CYP2C9 P11712 1/20 0.38

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
SCHEMBL16906879 0.89 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL19456637 0.89 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL21356341 0.87 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL17620509 0.87 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16906967 0.86 GUCY1B2 (0.51) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL17620944 0.85 GUCY1B2 (0.48) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL17620505 0.83 GUCY1B2 (0.48) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL17621215 0.83 GUCY1B2 (0.51) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16906968 0.83 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL17621213 0.82 GUCY1B2 (0.52) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9

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-3194382-B1 PYRAZOLE DERIVATIVES AS SGC STIMULATORS CYCLERION THERAPEUTICS INC (US) 2021-09-08 — — EP disclosed
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