SCHEMBL29250180

SCHEMBL29250180

CN1CCN(C(=O)C2CN(c3ccc4c(c3)Oc3cc(N5CC(C(=O)N6CCN(C)CC6)C5)ccc3C43C(=[N+]=[N-])C(=O)c4ccc(C(=O)NCCOCCOCCCCCCCl)cc43)C2)CC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 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
SCHEMBL30112713 1.00 OPRM1 (0.34) OPRM1
SCHEMBL29250147 0.94 OPRM1 (0.32) OPRM1
SCHEMBL30112711 0.94 OPRM1 (0.32) OPRM1
SCHEMBL29250145 0.93 NOTUM (0.32) OPRM1
SCHEMBL30112752 0.93 NOTUM (0.32) OPRM1
SCHEMBL24942954 0.91 OPRM1 (0.34) OPRM1
SCHEMBL30112687 0.91 OPRM1 (0.31) OPRM1
SCHEMBL30112637 0.91 OPRM1 (0.33) OPRM1
SCHEMBL30112684 0.90 OPRM1 (0.31) OPRM1
SCHEMBL30112626 0.90 OPRM1 (0.31) OPRM1

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
CN-118339156-A 2-Diazo-3-oxo-2, 3-dihydrospiro [ indene-1, 9' -xanthene ] derivatives and similar compounds as photoactive fluorescent compounds for protein labelling 爱康治疗公司 2024-07-12 — — CN disclosed
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