SCHEMBL30887562

SCHEMBL30887562

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 15/20 0.64
▸ OPRM1 P35372 11/20 0.64
▸ OPRK1 P41145 2/20 0.58
▸ KISS1R Q969F8 2/20 0.52

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
SCHEMBL29994099 0.94 OPRD1 (0.65) OPRD1OPRM1OPRK1KISS1R
SCHEMBL29472198 0.93 OPRD1 (0.58) OPRD1OPRM1OPRK1
SCHEMBL29472190 0.88 OPRD1 (0.54) OPRD1OPRM1OPRK1KISS1R
SCHEMBL30104127 0.86 ACE (0.52) OPRD1OPRM1OPRK1
SCHEMBL29993909 0.86 OPRD1 (0.56) OPRD1OPRM1OPRK1KISS1R
SCHEMBL30951648 0.85 OPRD1 (0.75) OPRD1OPRM1OPRK1KISS1R
SCHEMBL31257021 0.85 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL30293830 0.85 ACE (0.50) OPRD1OPRM1OPRK1KISS1R
SCHEMBL29804710 0.85 ACE (0.54) OPRD1OPRM1OPRK1KISS1R
Laminin SCHEMBL2182800 0.85 OPRD1 (0.55) OPRD1OPRM1OPRK1KISS1R

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-117924471-A Antibodies or antigen binding fragments that specifically bind E2 proteins and uses thereof 杭州傲锐生物医药科技有限公司 2024-04-26 — — CN disclosed
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