SCHEMBL31661918

SCHEMBL31661918

NC(=O)c1cc2cnn(C3CC3)c2cc1Oc1ccc(OCCC(=O)N2CC3CC(C2)O3)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.34
GAA P10253 1/20 0.32
PRMT5 O14744 3/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK1 P28482 1/20 0.30
S1PR1 P21453 1/20 0.30

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
SCHEMBL31661856 0.89 GAA (0.35) GAAPRMT5HPGDSMN1; SMN2
SCHEMBL31662349 0.82 GPR119 (0.36) GPR119PRMT5MAPK1
SCHEMBL31662129 0.79 MAPK1 (0.38) GPR119MAPK1
SCHEMBL31662391 0.78 GPR119 (0.37) GPR119PRMT5
SCHEMBL31661984 0.77 IKBKB (0.42) PRMT5
SCHEMBL31661966 0.76 HPGD (0.39) GAAHPGDSMN1; SMN2
SCHEMBL31661959 0.75 GAA (0.52) GAAHPGDSMN1; SMN2MAPK1
SCHEMBL31662174 0.75 TRPC6 (0.34) GAAPRMT5
SCHEMBL31662124 0.74 SCN9A (0.36)
SCHEMBL31662493 0.71 L3MBTL1 (0.41)

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