SCHEMBL3958285

SCHEMBL3958285

CC(CCC1CCCCC1)C[C@H](N)CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.44
METAP2 P50579 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.36
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
BCHE P06276 1/20 0.33
ALOX5 P09917 1/20 0.33
ITGB3 P05106 3/20 0.33
ITGA2B P08514 3/20 0.33
F2R P25116 2/20 0.33

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
SCHEMBL3961044 1.00 METAP1 (0.44) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3958289 1.00 METAP1 (0.44) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3966987 1.00 METAP1 (0.44) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3958667 1.00 METAP1 (0.44) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3967280 0.98 METAP1 (0.41) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3958014 0.98 METAP1 (0.41) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3958292 0.98 METAP1 (0.41) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3955384 0.95 METAP1 (0.38) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3958233 0.95 METAP1 (0.38) METAP1METAP2ALDH1A1MAPTSLC1A3
SCHEMBL3962889 0.95 METAP1 (0.38) METAP1METAP2ALDH1A1MAPTSLC1A3

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-1492761-B1 AMINO ACIDS WITH AFFINITY FOR THE ALPHA-2-DELTA-PROTEIN WARNER LAMBERT CO (US) 2009-07-22 EP claimed