SCHEMBL30452201

SCHEMBL30452201

C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NRP1 O14786 2/20 0.43
OPRM1 P35372 9/20 0.42
OPRK1 P41145 9/20 0.42
EPHA2 P29317 2/20 0.41
GRB2 P62993 1/20 0.41
APLNR P35414 1/20 0.40
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
MMP1 P03956 1/20 0.39
MMP3 P08254 1/20 0.39

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
SCHEMBL31670649 0.94 APLNR (0.42) NRP1OPRM1OPRK1APLNR
SCHEMBL9577364 0.91 DPP4 (0.41) OPRM1OPRK1GRB2
SCHEMBL15524993 0.91 DPP4 (0.41) OPRM1OPRK1GRB2
SCHEMBL7853147 0.91 DPP4 (0.41) OPRM1OPRK1GRB2
SCHEMBL1552453 0.88 OPRM1 (0.43) OPRM1OPRK1EPHA2GRB2APLNR
SCHEMBL20694547 0.88 NRP1 (0.46) NRP1OPRM1OPRK1EPHA2GRB2
SCHEMBL1552457 0.88 OPRM1 (0.43) OPRM1OPRK1EPHA2GRB2APLNR
SCHEMBL29569634 0.88 NTMT1 (0.47) OPRM1OPRK1GRB2APLNR
SCHEMBL38652121 0.88 APLNR (0.43) OPRM1OPRK1APLNR
SCHEMBL31195360 0.88 APLNR (0.42) OPRM1OPRK1APLNR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116162129-A Croaker swimming bladder polypeptide and application thereof 华南农业大学 2023-05-26 CN claimed
CN-116162129-A Croaker swimming bladder polypeptide and application thereof 华南农业大学 2023-05-26 CN disclosed
CN-116162129-A Croaker swimming bladder polypeptide and application thereof 华南农业大学 2023-05-26 CN disclosed