SCHEMBL29346537

SCHEMBL29346537

O=C1NCCCCC1n1c(=O)c(=O)[nH]c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 13/20 0.56
▸ OPRM1 P35372 11/20 0.56
▸ OPRK1 P41145 10/20 0.56
▸ OPRD1 P41143 8/20 0.56
▸ CHRM2 P08172 2/20 0.45
▸ CHRM4 P08173 2/20 0.45
▸ CHRM1 P11229 2/20 0.45
▸ CHRM3 P20309 1/20 0.45
▸ SLC18A3 Q16572 1/20 0.42
▸ DRD4 P21917 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL29346391 0.86 CHRM1 (0.53) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL31730155 0.86 CHRM1 (0.53) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL29346538 0.81 CRBN (0.52) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL26092381 0.77 OPRL1 (0.86) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL30910142 0.77 OPRL1 (0.86) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL2217118 0.75 OPRM1 (0.74) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL12028946 0.73 OPRM1 (0.67) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL29346392 0.73 DDB1 (0.61) KDM4EALDH1A1
SCHEMBL853223 0.72 OPRM1 (1.00) OPRL1OPRM1OPRK1OPRD1CHRM2
SCHEMBL1271556 0.70 OPRM1 (1.00) OPRL1OPRM1OPRK1OPRD1CHRM2

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-2024150815-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR 田辺三菱製薬株式会社 2024-07-18 — — WO disclosed
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