SCHEMBL30401046

SCHEMBL30401046

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 7/20 0.48
▸ CALCR P30988 7/20 0.48
▸ KEAP1 Q14145 6/20 0.46
▸ F2 P00734 2/20 0.46
▸ CALCRL Q16602 2/20 0.44
▸ EPHA2 P29317 2/20 0.43

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
SCHEMBL30401355 0.92 CALCRL (0.52) RAMP3CALCRKEAP1F2CALCRL
SCHEMBL30402066 0.91 NPY2R (0.52) RAMP3CALCRKEAP1
SCHEMBL29777837 0.89 RAMP3 (0.54) RAMP3CALCR
SCHEMBL30401081 0.89 MAPK8 (0.47) RAMP3CALCRKEAP1F2CALCRL
SCHEMBL30311400 0.88 CALCRL (0.45) RAMP3CALCRF2CALCRL
SCHEMBL9058997 0.87 RAMP3 (0.56) RAMP3CALCRKEAP1CALCRL
SCHEMBL9058995 0.87 RAMP3 (0.56) RAMP3CALCRKEAP1CALCRL
SCHEMBL30401193 0.87 NPY2R (0.52) RAMP3CALCR
SCHEMBL30311319 0.87 CMA1 (0.47) F2
Acetic Acid SCHEMBL30311282 0.85 CMA1 (0.46) F2CALCRL

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-116003529-A Polypeptide and application thereof in repairing mucous membrane injury or skin injury 四川好医生攀西药业有限责任公司 2023-04-25 — — CN claimed
CN-116003529-A Polypeptide and application thereof in repairing mucous membrane injury or skin injury 四川好医生攀西药业有限责任公司 2023-04-25 — — CN disclosed
Send feedback