SCHEMBL14780592

SCHEMBL14780592

Nc1ccc(C[C@H](N)C(=O)O)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.49
USP2 O75604 3/20 0.49
PKM P14618 3/20 0.49
ALOX15 P16050 3/20 0.49
KDM4E B2RXH2 3/20 0.49
HIF1A Q16665 2/20 0.49
RECQL P46063 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
CYP3A4 P08684 2/20 0.49
NFKB1 P19838 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
BLM P54132 2/20 0.49
PMP22 Q01453 2/20 0.49
KMT2A Q03164 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
RGS12 O14924 1/20 0.49
CYP2C9 P11712 1/20 0.49
CASP1 P29466 1/20 0.49

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
SCHEMBL9172559 0.88 SLC7A5 (0.55) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL8306982 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL4249865 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL28318850 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL4242294 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL4242870 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL15390388 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL4249863 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
SCHEMBL11559690 0.80 SLC7A5 (0.47) HSD17B10USP2PKMALOX15KDM4E
Hydrochloric Acid SCHEMBL30461880 0.79 SLC7A5 (0.46) HSD17B10USP2PKMALOX15KDM4E

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