SCHEMBL28890641

SCHEMBL28890641

NCC(=O)N1CCC[C@H]1C(=O)NC(CCC(N)=O)C(=O)O.NCC(=O)N1CCC[C@H]1C(=O)NC(CCC(N)=O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.42
ACE P12821 2/20 0.40
ITGB1 P05556 2/20 0.40
ITGA4 P13612 1/20 0.40
DPP4 P27487 3/20 0.39
PREP P48147 1/20 0.39
FAP Q12884 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
XIAP P98170 1/20 0.39
GRB2 P62993 1/20 0.39
PLG P00747 1/20 0.38
NTMT1 Q9BV86 1/20 0.38
ITGA5 P08648 1/20 0.37

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
SCHEMBL17997394 1.00 F2 (0.42) F2ACEITGB1ITGA4DPP4
SCHEMBL30563305 0.95 GRB2 (0.44) F2ACEGRB2NTMT1
SCHEMBL30563217 0.92 GRB2 (0.42) F2ACEITGB1ITGA4GRB2
SCHEMBL31544467 0.92 APLNR (0.40) F2ITGB1ITGA4FAPGRB2
SCHEMBL28890650 0.92 APLNR (0.40) F2ITGB1ITGA4FAPGRB2
SCHEMBL4726312 0.92 APLNR (0.40) F2ITGB1ITGA4FAPGRB2
SCHEMBL4726314 0.92 APLNR (0.40) F2ITGB1ITGA4FAPGRB2
SCHEMBL1170124 0.91 ACE (0.44) F2ACEITGB1ITGA4DPP4
SCHEMBL1170125 0.91 ACE (0.44) F2ACEITGB1ITGA4DPP4
SCHEMBL30563229 0.89 ACE (0.45) F2ACE

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-115024996-A Composite polypeptide for improving expression lines and application and cosmetic composition thereof 新生活化妆品科技(上海)有限公司 2022-09-09 CN disclosed