SCHEMBL31598852

SCHEMBL31598852

CC[C@H](C)[C@H](NC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57
▸ RAMP3 O60896 9/20 0.55
▸ CALCR P30988 9/20 0.55
▸ NPY2R P49146 6/20 0.54
▸ NPY4R P50391 6/20 0.54
▸ NPY5R Q15761 6/20 0.54
▸ NPY1R P25929 4/20 0.54
▸ NMUR2 Q9GZQ4 1/20 0.53
▸ NMUR1 Q9HB89 1/20 0.53
▸ CXCR4 P61073 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
SCHEMBL30432420 0.90 RAMP3 (0.56) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL30974529 0.89 NMUR2 (0.52) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL30495634 0.89 NPY2R (0.59) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL30262203 0.88 NPY2R (0.59) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30567708 0.88 NPY2R (0.61) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL30906464 0.88 NPY2R (0.70) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30974448 0.87 RAMP3 (0.57) RAMP3CALCRNMUR2NMUR1
SCHEMBL30844389 0.86 NPY2R (0.51) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30712231 0.86 NMUR2 (0.54) RAMP3CALCRNMUR2NMUR1
SCHEMBL31067242 0.86 NTSR1 (0.47) MAPK8MAPK9MAPK10RAMP3CALCR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058845-A Fatty acid modified antioxidant peptide and application thereof 青岛双元泰和药业有限公司 2025-05-30 — — CN claimed
CN-120058845-A Fatty acid modified antioxidant peptide and application thereof 青岛双元泰和药业有限公司 2025-05-30 — — CN disclosed
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