SCHEMBL29564909

SCHEMBL29564909

N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.63
OPRD1 P41143 2/20 0.63
GHSR Q92847 1/20 0.56

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
SCHEMBL30169323 0.98 OPRM1 (0.62) OPRM1OPRD1GHSR
SCHEMBL30051966 0.98 OPRM1 (0.65) OPRM1OPRD1
SCHEMBL30051166 0.96 OPRM1 (0.64) OPRM1OPRD1GHSR
SCHEMBL30503003 0.93 OPRD1 (0.68) OPRM1OPRD1
SCHEMBL29564602 0.93 OPRM1 (0.62) OPRM1OPRD1GHSR
SCHEMBL30052868 0.93 KDM4E (0.60) OPRM1OPRD1
SCHEMBL7588967 0.92 OPRM1 (0.71) OPRM1OPRD1
SCHEMBL30122992 0.92 OPRD1 (0.67) OPRM1OPRD1
SCHEMBL31454249 0.91 OPRD1 (0.65) OPRM1OPRD1
SCHEMBL30464831 0.91 OPRM1 (0.64) OPRM1OPRD1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4225780-A2 REGULATORS OF CELL DIVISION Technische Universität Dresden (DE) 2023-08-16 EP claimed
WO-2022074072-A2 REGULATORS OF CELL DIVISION Technische Universität Dresden (DE) 2022-04-14 WO claimed
EP-4225780-A2 REGULATORS OF CELL DIVISION Technische Universität Dresden (DE) 2023-08-16 EP disclosed
WO-2022074072-A2 REGULATORS OF CELL DIVISION Technische Universität Dresden (DE) 2022-04-14 WO disclosed