SCHEMBL12532003

SCHEMBL12532003

NC(Cc1ccc(O)c(N=O)c1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 5/20 0.69
USP2 O75604 3/20 0.69
PTGS1 P23219 2/20 0.69
KDM4E B2RXH2 2/20 0.69
ALOX15 P16050 2/20 0.69
RECQL P46063 2/20 0.69
HIF1A Q16665 2/20 0.69
HSD17B10 Q99714 2/20 0.69
TDP1 Q9NUW8 2/20 0.69
EGFR P00533 1/20 0.69
LCK P06239 1/20 0.69
FYN P06241 1/20 0.69
ADORA3 P0DMS8 1/20 0.69
HTR2A P28223 1/20 0.69
PTGS2 P35354 1/20 0.69
PKM P14618 3/20 0.50
ALPI P09923 1/20 0.50
XIAP P98170 1/20 0.50
GRIA2 P42262 1/20 0.49
NOS3 P29474 2/20 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
SCHEMBL10135632 1.00 SLC7A5 (0.69) SLC7A5USP2PTGS1KDM4EALOX15
SCHEMBL18403864 0.85 SLC7A5 (0.65) SLC7A5USP2PTGS1KDM4EALOX15
Levodopa SCHEMBL28247704 0.83 SLC7A5 (0.96) SLC7A5USP2PTGS1KDM4EALOX15
SCHEMBL30766325 0.82 SLC7A5 (0.61) SLC7A5USP2PTGS1KDM4EALOX15
SCHEMBL16266304 0.82 SLC7A5 (0.61) SLC7A5USP2PTGS1KDM4EALOX15
SCHEMBL14032348 0.82 SLC7A5 (0.61) SLC7A5USP2PTGS1KDM4EALOX15
Levodopa SCHEMBL704089 0.82 SLC7A5 (1.00) SLC7A5USP2PTGS1KDM4EALOX15
Levodopa SCHEMBL116907 0.82 SLC7A5 (1.00) SLC7A5USP2PTGS1KDM4EALOX15
Levodopa SCHEMBL20582239 0.82 SLC7A5 (1.00) SLC7A5USP2PTGS1KDM4EALOX15
Levodopa SCHEMBL29975814 0.82 SLC7A5 (1.00) SLC7A5USP2PTGS1KDM4EALOX15

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3827093-A1 SINGLE MOLECULE SEQUENCING IDENTIFICATION OF POST-TRANSLATIONAL MODIFICATIONS ON PROTEINS Board of Regents, The University of Texas System (US) 2021-06-02 EP disclosed
WO-2020023488-A1 SINGLE MOLECULE SEQUENCING IDENTIFICATION OF POST-TRANSLATIONAL MODIFICATIONS ON PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-01-30 WO disclosed
EP-3158073-B1 COMPOSITIONS AND METHODS FOR MAKING (S)-NORCOCLAURINE AND (S)-NORLAUDANOSOLINE, AND SYNTHESIS INTERMEDIATES THEREOF EPIMERON INC (CA) 2019-10-23 EP disclosed
EP-1917020-B1 MONOMETHYLVALINE COMPOUNDS HAVING PHENYLALANINE SIDE-CHAIN MODIFICATIONS AT THE C-TERMINUS SEATTLE GENETICS INC (US) 2016-05-25 EP disclosed
EP-2327767-A1 Nitrilases Verenium Corporation (US) 2011-06-01 EP disclosed
EP-2327765-A1 Nitrilases Verenium Corporation (US) 2011-06-01 EP disclosed
EP-2319919-A1 Nitrilases Verenium Corporation (US) 2011-05-11 EP disclosed