SCHEMBL31665896

SCHEMBL31665896

CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 5/20 0.56
▸ RAMP1 O60894 1/20 0.54
▸ DPP3 Q9NY33 5/20 0.54
▸ OPRD1 P41143 1/20 0.52
▸ CXCR4 P61073 1/20 0.51
▸ CCKBR P32239 1/20 0.51

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
SCHEMBL30199355 0.87 CXCR4 (0.61) CALCRLCXCR4CCKBR
SCHEMBL29426589 0.86 AGTR1 (0.60) DPP3
SCHEMBL30726617 0.86 NPY1R (0.64) CCKBR
SCHEMBL30974317 0.86 DPP3 (0.58) CALCRLRAMP1DPP3CXCR4CCKBR
SCHEMBL31402666 0.85 AGTR2 (0.61) DPP3
SCHEMBL31402672 0.85 KISS1R (0.63) DPP3
SCHEMBL30256961 0.85 CXCR4 (0.59) CXCR4CCKBR
SCHEMBL30633418 0.85 DPP3 (0.60) DPP3OPRD1CXCR4CCKBR
SCHEMBL18272128 0.84 CALCRL (0.68) CALCRLRAMP1
SCHEMBL30973980 0.84 DPP3 (0.58) CALCRLRAMP1DPP3CXCR4CCKBR

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-120365364-A Fugu obscurus-derived small molecular peptide and application thereof 中国农业大学 2025-07-25 — — CN disclosed
Send feedback