SCHEMBL31670628

SCHEMBL31670628

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.55
▸ OPRD1 P41143 3/20 0.53
▸ NTSR1 P30989 2/20 0.52
▸ F2 P00734 4/20 0.52
▸ HCRTR1 O43613 1/20 0.52
▸ HCRTR2 O43614 1/20 0.52
▸ C5AR1 P21730 1/20 0.52
▸ CRHR1 P34998 1/20 0.50
▸ CRHR2 Q13324 1/20 0.50

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
SCHEMBL31670617 0.88 CALCR (0.55) CALCROPRD1F2HCRTR1HCRTR2
SCHEMBL31670652 0.86 F2 (0.51) CALCROPRD1NTSR1F2HCRTR1
SCHEMBL32691451 0.86 SLC6A2 (0.59) CALCROPRD1NTSR1F2C5AR1
SCHEMBL30536330 0.84 CALCR (0.66) CALCRF2HCRTR1HCRTR2C5AR1
SCHEMBL32691458 0.84 SLC6A2 (0.61) OPRD1NTSR1F2C5AR1
SCHEMBL31366723 0.84 LNPEP (0.54) CALCROPRD1NTSR1F2
SCHEMBL30607303 0.84 CALCR (0.69) CALCRF2HCRTR1HCRTR2CRHR1
SCHEMBL31683370 0.83 CALCR (0.70) CALCRF2HCRTR1HCRTR2CRHR1
SCHEMBL30432655 0.83 CALCR (0.65) CALCRF2HCRTR1HCRTR2CRHR1
SCHEMBL31182521 0.83 F2 (0.73) CALCRF2HCRTR1HCRTR2CRHR1

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
Send feedback