SCHEMBL16634488

SCHEMBL16634488

NCc1ccc([N+](=O)[O-])cc1B(O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.46
CYP1A2 P05177 1/20 0.44
TDP1 Q9NUW8 5/20 0.43
ALDH1A1 P00352 4/20 0.43
CYP3A4 P08684 3/20 0.43
TSHR P16473 3/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
HTT P42858 2/20 0.40
ERN1 O75460 1/20 0.40
GPR35 Q9HC97 2/20 0.40
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALOX15 P16050 1/20 0.39

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
SCHEMBL29957553 1.00 LOXL2 (0.46) LOXL2CYP1A2TDP1ALDH1A1CYP3A4
SCHEMBL1517135 0.85 CYP1A2 (0.45) CYP1A2TDP1ALDH1A1CYP3A4TSHR
SCHEMBL29954542 0.83 TSHR (0.45) CYP1A2TDP1ALDH1A1CYP3A4TSHR
SCHEMBL2555778 0.81 CYP1A2 (0.42) CYP1A2TDP1ALDH1A1CYP3A4TSHR
SCHEMBL16576663 0.78 CYP1A2 (0.40) CYP1A2TDP1ALDH1A1CYP3A4TSHR
SCHEMBL2062221 0.78 LOXL2 (0.55) LOXL2CYP1A2TDP1ALDH1A1CYP3A4
SCHEMBL7253099 0.78 TSHR (0.50) TDP1ALDH1A1CYP3A4TSHRGAA
SCHEMBL6691566 0.77 GPR35 (0.56) LOXL2CYP1A2TDP1ALDH1A1CYP3A4
SCHEMBL11304556 0.77 ALDH1A1 (0.61) LOXL2CYP1A2TDP1ALDH1A1CYP3A4
SCHEMBL28405139 0.77 KMT2A (0.57) CYP1A2ALDH1A1CYP3A4TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117270235-A Contact lens having a lubricious coating thereon 爱尔康公司 2023-12-22 CN claimed
CN-111566517-B Contact lens having a lubricious coating thereon 爱尔康公司 2023-11-10 CN claimed
EP-3746820-B1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON ALCON INC (CH) 2022-02-16 EP claimed
US-10962803-B2 Contact lenses with a lubricious coating thereon ALCON INC. (CH) 2021-03-30 US claimed
EP-3746820-A1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON Alcon Inc. (CH) 2020-12-09 EP claimed
CN-111566517-A Contact lenses having lubricious coating thereon 爱尔康公司 2020-08-21 CN claimed
US-20190235277-A1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON ALCON INC. (CH) 2019-08-01 US claimed
CN-117270235-A Contact lens having a lubricious coating thereon 爱尔康公司 2023-12-22 CN disclosed
CN-111566517-B Contact lens having a lubricious coating thereon 爱尔康公司 2023-11-10 CN disclosed
EP-3746820-B1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON ALCON INC (CH) 2022-02-16 EP disclosed
US-11061169-B2 Contact lens with phosphorylcholine-modified polyvinylalcohols therein ALCON INC. (CH) 2021-07-13 US disclosed
US-10962803-B2 Contact lenses with a lubricious coating thereon ALCON INC. (CH) 2021-03-30 US disclosed
EP-3746820-A1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON Alcon Inc. (CH) 2020-12-09 EP disclosed
CN-111566517-A Contact lenses having lubricious coating thereon 爱尔康公司 2020-08-21 CN disclosed
WO-2020100090-A1 CONTACT LENS WITH PHOSPHORYLCHOLINE-MODIFIED POLYVINYLALCOHOLS THEREIN ALCON INC. (CH) 2020-05-22 WO disclosed
US-20200158913-A1 CONTACT LENS WITH PHOSPHORYLCHOLINE-MODIFIED POLYVINYLALCOHOLS THEREIN ALCON INC. (CH) 2020-05-21 US disclosed
US-20190235277-A1 CONTACT LENSES WITH A LUBRICIOUS COATING THEREON ALCON INC. (CH) 2019-08-01 US disclosed
US-10088476-B2 Volume response sensors having analyte controlled reversible crosslinking THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-10-02 US disclosed
US-20160252505-A1 VOLUME RESPONSE SENSORS HAVING ANALYTE CONTROLLED REVERSIBLE CROSSLINKING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOI S (US) 2016-09-01 US disclosed
WO-2015053975-A1 VOLUME RESPONSE SENSORS HAVING CONTROLLED REVERSIBLE CROSSLINKING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-04-16 WO disclosed