SCHEMBL31662267

SCHEMBL31662267

Cn1ncc2cc(C(N)=O)cc(Oc3ccc(OCCC(=O)N4C5COCC4C5)cc3F)c21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 8/20 0.34
HRH3 Q9Y5N1 1/20 0.31
STING1 Q86WV6 1/20 0.31
PRMT5 O14744 1/20 0.31
AR P10275 1/20 0.31
OPRM1 P35372 4/20 0.30
OPRD1 P41143 4/20 0.30
OPRK1 P41145 4/20 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
SCHEMBL31662156 0.91 SCN9A (0.37) SCN9ASTING1PRMT5
SCHEMBL31661971 0.90 SCN9A (0.36) SCN9AHRH3STING1AROPRM1
SCHEMBL31662000 0.85 DRD4 (0.34) SCN9APRMT5AR
SCHEMBL31662226 0.85 GAA (0.45) HRH3
SCHEMBL31662381 0.84 SCN9A (0.37) SCN9AAR
SCHEMBL31662120 0.83 SCN9A (0.36) SCN9AOPRM1OPRD1OPRK1
SCHEMBL31661963 0.82 SCN9A (0.36) SCN9ASTING1OPRM1OPRD1OPRK1
SCHEMBL31662015 0.82 SCN9A (0.36) SCN9ASTING1OPRM1OPRD1OPRK1
SCHEMBL31661947 0.82 SCN9A (0.36) SCN9AHRH3OPRM1OPRD1OPRK1
SCHEMBL31662603 0.82 SCN9A (0.38) SCN9AAROPRM1OPRD1OPRK1

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