SCHEMBL16351238

SCHEMBL16351238

CCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)C(CCCCN)NC(=O)[C@@H](N)[C@@H](C)O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.42
▸ GRB2 P62993 1/20 0.42
▸ APLNR P35414 1/20 0.41
▸ CAPN1 P07384 6/20 0.40
▸ NTSR2 O95665 2/20 0.40
▸ NTSR1 P30989 2/20 0.40
▸ PLG P00747 3/20 0.40
▸ PLAT P00750 2/20 0.40
▸ CTSB P07858 1/20 0.39
▸ F10 P00742 1/20 0.37
▸ PRSS1 P07477 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
SCHEMBL16351033 0.92 APLNR (0.48) GRB2APLNRCAPN1NTSR2NTSR1
SCHEMBL16351239 0.92 APLNR (0.48) GRB2APLNRCAPN1NTSR2NTSR1
SCHEMBL16330330 0.92 APLNR (0.48) GRB2APLNRCAPN1NTSR2NTSR1
SCHEMBL16350326 0.89 OPRM1 (0.43) F2GRB2APLNRCAPN1PLG
SCHEMBL29530904 0.80 XIAP (0.48) F2GRB2CAPN1NTSR2NTSR1
SCHEMBL10783008 0.80 ACE (0.53) —
SCHEMBL8760024 0.80 ACE (0.53) —
SCHEMBL10782979 0.80 ACE (0.53) —
SCHEMBL8760014 0.80 ACE (0.53) —
SCHEMBL1246765 0.80 DPP4 (0.42) GRB2CAPN1NTSR2NTSR1

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
US-8263739-B2 also targeting tumor cells that express vascular endothelial growth factor neuropilin-1 receptor; radiotherapy; radiopharmaceuticals; treating angiogenesis BRACCO SUISSE SA (CH) 2012-09-11 — — US disclosed
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