SCHEMBL31662349

SCHEMBL31662349

NC(=O)c1cc2cnn(C3CC3)c2cc1Oc1ccc(OCCCCl)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.36
MCHR2 Q969V1 5/20 0.35
MCHR1 Q99705 5/20 0.35
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
PRMT5 O14744 2/20 0.33
SYK P43405 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
SCN9A Q15858 1/20 0.33
MAPK1 P28482 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
SCHEMBL31661984 0.86 IKBKB (0.42) MCHR2MCHR1PRMT5HRH3
SCHEMBL31662391 0.86 GPR119 (0.37) GPR119MCHR2MCHR1PDE1APDE1B
SCHEMBL31662129 0.85 MAPK1 (0.38) GPR119PDE1APDE1BPDE1CSYK
SCHEMBL31661918 0.82 GPR119 (0.34) GPR119PRMT5MAPK1
SCHEMBL31662113 0.77 SCN9A (0.39) SYKSCN9A
SCHEMBL31662133 0.76 OPRK1 (0.38) SYKSCN9A
SCHEMBL31662453 0.75 MKNK1 (0.39) SYKSCN9A
SCHEMBL31662042 0.75 IRAK4 (0.41) SYKHRH3SCN9A
SCHEMBL31662511 0.74 SYK (0.38) SYKSCN9A
SCHEMBL31662493 0.73 L3MBTL1 (0.41) SYKSCN9A

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-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed