SCHEMBL26004598

SCHEMBL26004598

Cc1cc(CN2CCC3(CC2)OC(C(N)=O)c2ccc(Cl)cc23)on1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ KCNH2 Q12809 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40
▸ THRB P10828 1/20 0.35
▸ PRCP P42785 1/20 0.35
▸ AKT1 P31749 1/20 0.34
▸ GLP1R P43220 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL26015271 0.86 SIGMAR1 (0.45) SIGMAR1PRCP
SCHEMBL26015090 0.85 SIGMAR1 (0.44) SIGMAR1PRCP
SCHEMBL26014965 0.85 SIGMAR1 (0.41) SIGMAR1PRCPGLP1R
SCHEMBL26004355 0.83 SIGMAR1 (0.44) SIGMAR1PRCP
SCHEMBL26004734 0.83 SIGMAR1 (0.46) SIGMAR1PRCP
SCHEMBL26014962 0.83 SIGMAR1 (0.45) SIGMAR1DRD2KCNH2ENPP2PRCP
SCHEMBL26015093 0.83 SIGMAR1 (0.48) SIGMAR1DRD2PRCP
SCHEMBL26004752 0.82 SIGMAR1 (0.45) SIGMAR1PRCP
SCHEMBL26004354 0.82 SIGMAR1 (0.49) SIGMAR1PRCP
SCHEMBL26015269 0.81 MEN1 (0.48) SIGMAR1PRCPLMNA

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
WO-2023154314-A1 SPIRO PIPERIDINE DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 — — WO disclosed
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