Paranitrobenzyl Alcohol

Paranitrobenzyl Alcohol

SCHEMBL5689999

O=C(O)CC(=O)O.O=[N+]([O-])c1ccc(CO)cc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.56
▸ CYP2C19 P33261 3/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ CYP1A2 P05177 2/20 0.50
▸ LOXL2 Q9Y4K0 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ PTPRF P10586 1/20 0.49
▸ PTPN2 P17706 1/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ PTPN11 Q06124 1/20 0.49
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CES1 P23141 2/20 0.47
▸ MAPT P10636 1/20 0.46
▸ IDO1 P14902 1/20 0.46
▸ CES2 O00748 1/20 0.46
▸ SRD5A2 P31213 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46

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
Paranitrobenzyl Alcohol SCHEMBL114620 0.88 TSHR (0.69) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
Paranitrobenzyl Alcohol SCHEMBL28621041 0.85 ALDH1A1 (0.64) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
Malonic Acid SCHEMBL8847214 0.84 CYP2C19 (0.51) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
SCHEMBL17154335 0.82 POLB (0.63) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
SCHEMBL413193 0.81 SRD5A2 (0.65) TSHRALDH1A1LOXL2TDP1LMNA
Paranitrobenzyl Alcohol SCHEMBL28005884 0.81 AKR1C3 (0.61) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
Paranitrobenzyl Alcohol SCHEMBL29171084 0.81 TSHR (0.51) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
Paranitrobenzyl Alcohol SCHEMBL8707517 0.79 TSHR (0.53) TSHRCYP2C19ALDH1A1LOXL2MEN1
SCHEMBL76204 0.79 CYP2C19 (0.64) TSHRCYP2C19ALDH1A1CYP1A2LOXL2
SCHEMBL30643815 0.79 CYP2C19 (0.64) TSHRCYP2C19ALDH1A1CYP1A2LOXL2

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-214763883-U Multistage screening and purifying equipment for producing p-nitrobenzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN claimed
CN-214766968-U Filter equipment is used in production of p nitro benzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN claimed
CN-108060186-B Biological preparation method of p-nitrobenzyl alcohol malonic acid monoester 台州学院 2020-08-28 — — CN claimed
JP-7099983-A — — None — — JP disclosed
CN-114773203-B Production process of p-nitrobenzyl alcohol 浙江华洲药业有限公司 2023-12-15 — — CN disclosed
CN-114773203-A Production process of p-nitrobenzyl alcohol 浙江华洲药业有限公司 2022-07-22 — — CN disclosed
CN-214766968-U Filter equipment is used in production of p nitro benzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN disclosed
CN-214763883-U Multistage screening and purifying equipment for producing p-nitrobenzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN disclosed
CN-214763387-U Vacuum distillation device is used in production of p-nitrobenzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN disclosed
CN-214763387-U Vacuum distillation device is used in production of p-nitrobenzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN disclosed
CN-214763387-U Vacuum distillation device is used in production of p-nitrobenzyl alcohol malonic acid monoester 江西环泰化工有限公司 2021-11-19 — — CN disclosed
CN-108060186-B Biological preparation method of p-nitrobenzyl alcohol malonic acid monoester 台州学院 2020-08-28 — — CN disclosed
CN-108060186-B Biological preparation method of p-nitrobenzyl alcohol malonic acid monoester 台州学院 2020-08-28 — — CN disclosed
CN-111019980-A Efficient biosynthesis method of mono-p-nitrobenzyl malonate 牡丹江医学院 2020-04-17 — — CN disclosed
CN-103540622-B Method for synthesizing p-nitrobenzyl alcohol malonate monoacid ester through enzyme catalysis NANJING TECH UNIVERSITY (CN) 2016-04-13 — — CN disclosed
CN-103540622-B Method for synthesizing p-nitrobenzyl alcohol malonate monoacid ester through enzyme catalysis NANJING TECH UNIVERSITY (CN) 2016-04-13 — — CN disclosed
EP-1008655-B1 PROCESS FOR PRODUCING MALONIC ACID DERIVATIVES MITSUBISHI RAYON CO (JP) 2006-05-17 — — EP disclosed
US-5516934-A Process for producing mono-P-nitrobenzyl malonate NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1996-05-14 — — US disclosed
JP-H0799983-A PRODUCTION OF P-NITROBENZYL ALCOHOL MALONIC ACID MONOESTER BY BACTERIUM NIPPON KAYAKU CO LTD 1995-04-18 — — JP disclosed
JP-H00799983-A — — 0001-01-01 — — JP disclosed
Send feedback