SCHEMBL31286296

SCHEMBL31286296

CC(C)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 4/20 0.57
▸ PRKACB P22694 1/20 0.53
▸ IL23R Q5VWK5 2/20 0.51
▸ NPBWR1 P48145 1/20 0.51
▸ ACE P12821 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
SCHEMBL30786424 1.00 GHSR (0.57) GHSRPRKACBIL23RNPBWR1ACE
SCHEMBL30138666 0.98 GHSR (0.57) GHSRPRKACBIL23RNPBWR1ACE
SCHEMBL30092973 0.96 IL23R (0.56) GHSRIL23R
SCHEMBL30093049 0.96 IL23R (0.56) GHSRIL23R
SCHEMBL31165840 0.96 ACE (0.54) GHSRACE
SCHEMBL30138559 0.95 GHSR (0.55) GHSRPRKACBIL23R
SCHEMBL31286297 0.95 GHSR (0.55) GHSRPRKACBIL23R
SCHEMBL30138631 0.95 GHSR (0.55) GHSRPRKACBIL23R
SCHEMBL31286295 0.95 GHSR (0.55) GHSRPRKACBIL23R
SCHEMBL31165849 0.94 ACE (0.56) GHSRACE

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-119345325-A Polypeptide composition with antibacterial activity and preparation method thereof 南通奥凯生物技术开发有限公司 2025-01-24 — — CN disclosed
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