SCHEMBL14780599

SCHEMBL14780599

Nc1ccc2cc(C[C@H](N)C(=O)O)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.58
PTGS1 P23219 2/20 0.58
KDM4E B2RXH2 1/20 0.58
USP2 O75604 1/20 0.58
EGFR P00533 1/20 0.58
LCK P06239 1/20 0.58
FYN P06241 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
ALOX15 P16050 1/20 0.58
HTR2A P28223 1/20 0.58
PTGS2 P35354 1/20 0.58
RECQL P46063 1/20 0.58
HIF1A Q16665 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
PKM P14618 2/20 0.53
ALPI P09923 1/20 0.53
XIAP P98170 1/20 0.53
PTPN1 P18031 2/20 0.52
GRIA2 P42262 1/20 0.48

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
Phenylalanine SCHEMBL4081350 0.86 SLC7A5 (0.67) SLC7A5PTGS1HSD17B10PKMALPI
Dl-Phenylalanine SCHEMBL4081344 0.86 SLC7A5 (0.67) SLC7A5PTGS1HSD17B10PKMALPI
SCHEMBL210104 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL29375097 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL29584308 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL29401985 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL29554654 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL93304 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL93303 0.85 SLC7A5 (0.65) SLC7A5PTGS1KDM4EUSP2EGFR
SCHEMBL837890 0.85 SLC7A5 (0.65) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9586988-B2 Compositions containing, methods involving, and uses of non-natural amino acids and polypeptides AMBRX, INC. (US) 2017-03-07 US disclosed
US-8557781-B2 Compositions containing, methods involving, and uses of non-natural amino acids and polypeptides AMBRX, INC. (US) 2013-10-15 US disclosed
US-8399614-B2 Compositions containing, methods involving, and uses of non-natural amino acids and polypeptides AMBRX, INC. (US) 2013-03-19 US disclosed