SCHEMBL31670645

SCHEMBL31670645

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)CN)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 3/20 0.54
▸ OPRD1 P41143 7/20 0.53
▸ CRHR1 P34998 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ NTSR1 P30989 2/20 0.49
▸ REN P00797 2/20 0.49

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
SCHEMBL31670651 0.88 NTSR1 (0.56) OPRD1NTSR1
SCHEMBL30586591 0.88 CALCR (0.58) CALCROPRD1NTSR1REN
SCHEMBL31670629 0.83 KEAP1 (0.50) —
SCHEMBL30512734 0.82 OPRD1 (0.53) OPRD1NTSR1REN
SCHEMBL29688342 0.82 CALCR (0.60) CALCROPRD1CRHR1CRHR2
SCHEMBL30586584 0.82 OPRD1 (0.59) OPRD1NTSR1REN
SCHEMBL31670617 0.82 CALCR (0.55) CALCROPRD1CRHR1CRHR2
SCHEMBL29728673 0.81 CALCR (0.60) CALCROPRD1CRHR1CRHR2
SCHEMBL30567725 0.81 BACE1 (0.55) —
SCHEMBL31182783 0.81 CALCR (0.63) CALCR

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
EP-3897693-B1 SYNTHETIC AND RECOMBINANT COLLAGEN PEPTIDES HAVING BIOLOGICAL ACTIVITY GELITA AG (DE) 2025-08-06 — — EP disclosed
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