SCHEMBL30637599

SCHEMBL30637599

O=C1CNC(=O)[C@@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CN1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.55
OPRD1 P41143 10/20 0.55
CXCR4 P61073 1/20 0.54
OPRK1 P41145 6/20 0.54

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
SCHEMBL30637590 1.00 OPRM1 (0.55) OPRM1OPRD1CXCR4OPRK1
SCHEMBL30637487 1.00 OPRM1 (0.55) OPRM1OPRD1CXCR4OPRK1
SCHEMBL30637559 1.00 OPRM1 (0.55) OPRM1OPRD1CXCR4OPRK1
SCHEMBL29519776 0.94 OPRM1 (0.52) OPRM1OPRD1CXCR4OPRK1
SCHEMBL29519649 0.94 OPRM1 (0.52) OPRM1OPRD1CXCR4OPRK1
SCHEMBL29519897 0.94 OPRM1 (0.52) OPRM1OPRD1CXCR4OPRK1
SCHEMBL12148795 0.92 HDAC8 (0.54) OPRM1OPRD1CXCR4OPRK1
SCHEMBL3205012 0.92 HRH3 (0.53) OPRM1OPRD1CXCR4OPRK1
SCHEMBL8135311 0.92 HDAC8 (0.54) OPRM1OPRD1CXCR4OPRK1
SCHEMBL12809436 0.92 HRH3 (0.53) OPRM1OPRD1CXCR4OPRK1

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
CN-112789286-B Carbon-terminal pentapeptide derivative of osteogenic growth peptide, preparation method and application thereof 陕西慧康生物科技有限责任公司 2023-08-29 CN disclosed
CN-112789286-B Carbon-terminal pentapeptide derivative of osteogenic growth peptide, preparation method and application thereof 陕西慧康生物科技有限责任公司 2023-08-29 CN disclosed