SCHEMBL31633285

SCHEMBL31633285

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.60
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57
▸ APLNR P35414 1/20 0.56
▸ NPY2R P49146 7/20 0.55
▸ NPY4R P50391 7/20 0.55
▸ NPY5R Q15761 7/20 0.55
▸ NPY1R P25929 6/20 0.55
▸ CXCR4 P61073 1/20 0.54
▸ GLP1R P43220 3/20 0.54
▸ GCGR P47871 1/20 0.53
▸ GIPR P48546 1/20 0.53

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
SCHEMBL29596813 0.95 CALCR (0.65) CALCRMAPK8MAPK9MAPK10NPY2R
SCHEMBL30668489 0.94 CALCR (0.63) CALCRMAPK8MAPK9MAPK10APLNR
SCHEMBL31633286 0.90 CALCR (0.65) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29596900 0.90 CALCR (0.65) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30938249 0.88 CALCR (0.68) CALCRMAPK8MAPK9MAPK10NPY2R
SCHEMBL29414492 0.88 CALCR (0.68) CALCRMAPK8MAPK9MAPK10NPY2R
SCHEMBL29416036 0.88 MAPK8 (0.63) CALCRMAPK8MAPK9MAPK10NPY1R
SCHEMBL30646299 0.88 MAPK8 (0.63) CALCRMAPK8MAPK9MAPK10NPY1R
SCHEMBL30938250 0.88 CALCR (0.67) CALCRMAPK8MAPK9MAPK10NPY2R
SCHEMBL29370426 0.88 CALCR (0.67) CALCRMAPK8MAPK9MAPK10NPY2R

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-114437233-B Directional synthesis method of polypeptide dimer 湖北健翔生物制药有限公司 2025-06-24 — — CN disclosed
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