SCHEMBL14724475

SCHEMBL14724475

N[C@H](Cc1ccc2c(c1)C=CCC2)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 5/20 0.50
PTGS1 P23219 2/20 0.50
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
EGFR P00533 1/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
ALOX15 P16050 1/20 0.50
HTR2A P28223 1/20 0.50
PTGS2 P35354 1/20 0.50
RECQL P46063 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TYR P14679 5/20 0.47
PKM P14618 2/20 0.45
ALPI P09923 1/20 0.45
XIAP P98170 1/20 0.45
GRB2 P62993 1/20 0.43

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
SCHEMBL5319999 0.86 SLC7A5 (0.53) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL5320539 0.77 SLC7A5 (0.53) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL25355937 0.76 SLC7A5 (0.58) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL3277943 0.76 SLC7A5 (0.58) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL3277939 0.76 SLC7A5 (0.58) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL3795406 0.75 SLC7A5 (0.57) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL3795409 0.75 SLC7A5 (0.57) SLC7A5PTGS1KDM4EUSP2EGFR
Hydrochloric Acid SCHEMBL11168584 0.75 SLC7A5 (0.57) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL7307850 0.74 GRIN2B (0.35) HTR2ATYR
Hydrochloric Acid SCHEMBL20236015 0.74 SLC7A5 (0.55) SLC7A5PTGS1KDM4EUSP2EGFR

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-2562181-A1 Potent ligands of the ghrelin receptor Universität Leipzig (DE) 2013-02-27 EP disclosed