SCHEMBL8633803

SCHEMBL8633803

NCCCN[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 2/20 0.49
FOLH1 Q04609 3/20 0.46
KMT2A Q03164 2/20 0.42
ALOX15 P16050 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
NOD1 Q9Y239 1/20 0.42
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
GSR P00390 1/20 0.37
RNPEP Q9H4A4 1/20 0.36
RIMKLA Q8IXN7 1/20 0.36
NAALAD2 Q9Y3Q0 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CPB2 Q96IY4 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 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
SCHEMBL30199558 0.95 FOLH1 (0.49) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL27146119 0.93 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL6428433 0.93 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL5495877 0.93 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL6428434 0.93 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL9954035 0.93 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL15387334 0.89 GGT1 (0.61) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL27546759 0.89 GGT1 (0.61) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL29448584 0.89 MAOA (0.45) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL20511491 0.86 GGT1 (0.50) GGT1FOLH1KMT2AALOX15BLM

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-5776875-A Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-07-07 US claimed