SCHEMBL22019478

SCHEMBL22019478

CNCC(=O)NCC(=O)NCC(=O)NC(C)C(=O)NCC(=O)N1CCCC1C(=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 7/20 0.41
▸ PREP P48147 5/20 0.41
▸ DPP4 P27487 4/20 0.41
▸ ACE P12821 5/20 0.38
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ XIAP P98170 1/20 0.34
▸ MLX Q9UH92 1/20 0.34
▸ REN P00797 3/20 0.34
▸ APLNR P35414 1/20 0.34
▸ CALCRL Q16602 1/20 0.34

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
SCHEMBL30558194 0.91 FAP (0.40) FAPPREPDPP4ACECHRM2
SCHEMBL30558187 0.87 FAP (0.42) FAPPREPDPP4ACEXIAP
SCHEMBL30558197 0.87 PREP (0.38) FAPPREPDPP4ACECHRM2
SCHEMBL23871403 0.87 FAP (0.42) FAPPREPDPP4ACECHRM2
SCHEMBL29308708 0.86 PREP (0.37) FAPPREPDPP4ACECHRM2
SCHEMBL30951791 0.83 CALCRL (0.42) FAPPREPDPP4ACEXIAP
SCHEMBL29308704 0.82 FAP (0.40) FAPAPLNRCALCRL
SCHEMBL26387434 0.82 FAP (0.40) FAPPREPDPP4APLNRCALCRL
SCHEMBL26391683 0.82 PREP (0.59) FAPPREPDPP4ACEREN
SCHEMBL30558198 0.81 ACE (0.45) ACEXIAPMLXREN

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
WO-2020099925-A2 PEPTIDES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING EYE DISEASES YUYU PHARMA, INC. (KR) 2020-05-22 — — WO disclosed
Send feedback