SCHEMBL16280591

SCHEMBL16280591

NOC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.50
SRC P12931 1/20 0.46
MAPT P10636 4/20 0.40
TSHR P16473 3/20 0.40
POLB P06746 2/20 0.40
CYP3A4 P08684 1/20 0.40
PARP1 P09874 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
F2 P00734 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 2/20 0.38
CES2 O00748 2/20 0.38
ALDH1A1 P00352 2/20 0.38
DAO P14920 1/20 0.38

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
SCHEMBL11101775 0.84 CES1 (0.53) CES1SRCMAPTTSHRPOLB
SCHEMBL621110 0.82 CES1 (0.52) CES1SRCMAPTTSHRPOLB
SCHEMBL277653 0.81 CES1 (0.65) CES1SRCMAPTTSHRCYP2C19
Methoxymethane SCHEMBL36163 0.79 CES1 (0.62) CES1SRCMAPTTSHRCYP2C19
SCHEMBL459656 0.79 CES1 (0.49) CES1SRCMAPTTSHRTDP1
SCHEMBL11072129 0.79 CES1 (0.53) CES1SRCMAPTTSHRHSD17B10
SCHEMBL8592886 0.78 KCNN4 (0.42) CES1SRCMAPTCYP2C19KMT2A
SCHEMBL1476483 0.78 CES1 (0.56) CES1SRCMAPTTSHRPOLB
SCHEMBL173918 0.78 CES1 (0.51) CES1SRCMAPTTSHRCYP3A4
SCHEMBL6528610 0.78 CES1 (0.47) CES1SRCMAPTTSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9587259-B2 Escherichia coli capable of producing 3-amino-4-hydroxybenzoic acid AJINOMOTO CO., INC. (JP) 2017-03-07 US disclosed
US-9587259-B2 Escherichia coli capable of producing 3-amino-4-hydroxybenzoic acid AJINOMOTO CO., INC. (JP) 2017-03-07 US disclosed
US-9447443-B2 Method for producing 3-acetylamino-4-hydroxybenzoic acid AJINOMOTO CO., INC. (JP) 2016-09-20 US disclosed
EP-2857510-A1 METHOD FOR PRODUCING 3-ACETYLAMINO-4-HYDROXYBENZOIC ACID Ajinomoto Co., Inc. (JP) 2015-04-08 EP disclosed
US-20150079644-A1 Method for Producing 3-Acetylamino-4-Hydroxybenzoic Acid AJINOMOTO CO., INC. (JP) 2015-03-19 US disclosed
EP-2821479-A1 ESCHERICHIA COLI CAPABLE OF PRODUCING 3-AMINO-4-HYDROXYBENZOIC ACID Ajinomoto Co., Inc. (JP) 2015-01-07 EP disclosed
EP-2821479-A1 ESCHERICHIA COLI CAPABLE OF PRODUCING 3-AMINO-4-HYDROXYBENZOIC ACID Ajinomoto Co., Inc. (JP) 2015-01-07 EP disclosed
US-20140364579-A1 Escherichia coli Capable of Producing 3-Amino-4-Hydroxybenzoic Acid AJINOMOTO CO., INC. (JP) 2014-12-11 US disclosed
US-20140364579-A1 Escherichia coli Capable of Producing 3-Amino-4-Hydroxybenzoic Acid AJINOMOTO CO., INC. (JP) 2014-12-11 US disclosed