SCHEMBL30138656

SCHEMBL30138656

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 5/20 0.56
▸ PRKACB P22694 1/20 0.53
▸ NPBWR1 P48145 1/20 0.52
▸ UTS2R Q9UKP6 1/20 0.52
▸ PRMT1 Q99873 1/20 0.52
▸ NMBR P28336 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
SCHEMBL29483773 0.98 GHSR (0.56) GHSRPRKACBNPBWR1UTS2RPRMT1
SCHEMBL29483771 0.98 GHSR (0.56) GHSRPRKACBNPBWR1UTS2RPRMT1
SCHEMBL29483772 0.98 GHSR (0.56) GHSRPRKACBNPBWR1UTS2RPRMT1
SCHEMBL29699792 0.97 GHSR (0.56) GHSRPRKACBUTS2RPRMT1NMBR
SCHEMBL29702283 0.97 GHSR (0.56) GHSRPRKACBUTS2RPRMT1NMBR
SCHEMBL29794180 0.96 GHSR (0.54) GHSRPRKACBUTS2RPRMT1NMBR
SCHEMBL29576199 0.96 GHSR (0.54) GHSRPRKACBUTS2RPRMT1NMBR
SCHEMBL31165874 0.96 ACE (0.54) PRMT1ACE
SCHEMBL31165850 0.96 ACE (0.54) PRMT1ACE
SCHEMBL31193784 0.96 ACE (0.54) PRMT1ACE

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-113896768-B Antibacterial peptides and their cosmetic or pharmaceutical compositions and uses 深圳市维琪医药研发有限公司 2022-10-14 — — CN disclosed
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