SCHEMBL5605249

SCHEMBL5605249

N[C@@H](Cc1ccccc1)C(=O)N(CO)CO

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.61
ALPI P09923 1/20 0.61
PKM P14618 1/20 0.61
PTGS1 P23219 1/20 0.61
XIAP P98170 1/20 0.61
SLC15A1 P46059 1/20 0.53
MC4R P32245 4/20 0.52
MC5R P33032 3/20 0.52
MC3R P41968 3/20 0.52
LTA4H P09960 1/20 0.50
SLC1A3 P43003 2/20 0.49
SLC1A2 P43004 2/20 0.49
SLC1A1 P43005 2/20 0.49
HDAC8 Q9BY41 2/20 0.47
CYP1A2 P05177 1/20 0.46
CTSC P53634 1/20 0.45
EPHX1 P07099 1/20 0.45
LAP3 P28838 2/20 0.44
ANPEP P15144 1/20 0.44

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
SCHEMBL6166496 0.84 ALPI (0.59) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL9200374 0.84 ALPI (0.59) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL9572329 0.84 MC4R (0.55) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL9872582 0.81 ALPI (0.56) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL836806 0.80 ALPI (0.63) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL30959049 0.80 ALPI (0.63) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL1764633 0.80 ALPI (0.63) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL26954884 0.80 ALPI (0.63) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL24785636 0.79 MC4R (0.56) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL2106555 0.79 ALPI (0.61) SLC7A5ALPIPKMPTGS1XIAP

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-1441724-B1 METHODS OF INCREASING ENDOGENOUS TESTOSTERONE LEVELS APPLIED RESEARCH SYSTEMS (AN) 2007-09-05 EP claimed