SCHEMBL2465468

SCHEMBL2465468

CCCCCCCCCCCCCC(CCl)C(C)=O.CCCN(C(=O)[C@H](N)Cc1ccccc1)[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.36
MMP1 P03956 8/20 0.36
MMP3 P08254 8/20 0.36
TLR2 O60603 1/20 0.36
FNTA P49354 3/20 0.36
FNTB P49356 3/20 0.36
PGGT1B P53609 3/20 0.36
MMP7 P09237 3/20 0.35

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
SCHEMBL8374436 0.89 ANPEP (0.40) FNTAFNTBPGGT1B
SCHEMBL9390635 0.89 ANPEP (0.40) FNTAFNTBPGGT1B
SCHEMBL9394697 0.89 ANPEP (0.40) FNTAFNTBPGGT1B
SCHEMBL7566039 0.88 ANPEP (0.37) FNTAFNTBPGGT1B
SCHEMBL6049152 0.83 ANPEP (0.39)
SCHEMBL3400148 0.83 ANPEP (0.39)
SCHEMBL8899669 0.81 ANPEP (0.37)
SCHEMBL7302277 0.78 NPC1 (0.41)
SCHEMBL7413964 0.77 ANPEP (0.39)
Phenylalanine SCHEMBL6663427 0.76 ALPI (0.55) MMP2MMP1MMP3MMP7

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
EP-1703855-B1 BIFURCATED STENT DELIVERY SYSTEM BOSTON SCIENT LTD (BB) 2011-09-21 EP claimed