SCHEMBL31303183

SCHEMBL31303183

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

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NRP1 O14786 3/20 0.52
▸ EPHA2 P29317 4/20 0.47
▸ OPRM1 P35372 3/20 0.44
▸ NTSR2 O95665 3/20 0.43
▸ NTSR1 P30989 3/20 0.43
▸ SORT1 Q99523 3/20 0.43
▸ CXCR4 P61073 1/20 0.42
▸ OPRK1 P41145 2/20 0.41
▸ XIAP P98170 1/20 0.41
▸ CALCRL Q16602 2/20 0.40
▸ GRB2 P62993 1/20 0.40

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
SCHEMBL30415970 0.92 NRP1 (0.51) NRP1EPHA2OPRM1NTSR2NTSR1
SCHEMBL22872708 0.92 NRP1 (0.54) NRP1EPHA2OPRM1NTSR2NTSR1
SCHEMBL29571627 0.90 NRP1 (0.54) NRP1OPRM1NTSR2NTSR1SORT1
SCHEMBL29750302 0.88 NRP1 (0.44) NRP1OPRM1NTSR2NTSR1SORT1
SCHEMBL31039951 0.87 OPRM1 (0.56) NRP1OPRM1NTSR2NTSR1SORT1
SCHEMBL8969918 0.86 EPHA2 (0.49) EPHA2OPRM1NTSR2NTSR1SORT1
SCHEMBL7788531 0.86 CXCR4 (0.45) NRP1EPHA2OPRM1NTSR2NTSR1
SCHEMBL31099291 0.86 GRB2 (0.49) NRP1OPRM1NTSR2NTSR1SORT1
SCHEMBL7785522 0.86 OPRM1 (0.43) NRP1EPHA2OPRM1NTSR2NTSR1
SCHEMBL31487190 0.85 NRP1 (0.47) NRP1OPRM1NTSR2NTSR1SORT1

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-2025032597-A1 HAIR GROWTH COMPOSITION SHOME DEBRAJ (IN) 2025-02-13 — — WO disclosed
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