SCHEMBL31484885

SCHEMBL31484885

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.50
▸ APLNR P35414 4/20 0.49
▸ CALCRL Q16602 2/20 0.47
▸ F2 P00734 1/20 0.47
▸ RAMP1 O60894 1/20 0.47
▸ OPRM1 P35372 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ ACE P12821 2/20 0.46

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
SCHEMBL31195334 0.90 CALCRL (0.53) C5AR1APLNRCALCRLF2RAMP1
SCHEMBL29569060 0.86 ITGB3 (0.48) C5AR1APLNRF2
SCHEMBL29568833 0.85 ITGB3 (0.48) C5AR1APLNRF2
SCHEMBL30480492 0.83 OPRM1 (0.55) OPRM1OPRD1
SCHEMBL30480493 0.83 OPRM1 (0.55) OPRM1OPRD1
SCHEMBL29569355 0.83 C5AR1 (0.55) C5AR1APLNR
SCHEMBL30427191 0.83 OPRM1 (0.48) C5AR1APLNRCALCRLRAMP1OPRM1
SCHEMBL29568917 0.83 ITGB3 (0.48) C5AR1APLNRF2
SCHEMBL29568884 0.83 C5AR1 (0.54) C5AR1APLNR
SCHEMBL30630359 0.82 SLC6A2 (0.48) CALCRLRAMP1OPRM1OPRD1ACE

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-2025067206-A1 CYCLIC PEPTIDE COMPOUND AND USE THEREOF 深圳众格生物科技有限公司 2025-04-03 — — WO disclosed
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