SCHEMBL85544

SCHEMBL85544

O=[N+]([O-])c1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
HIF1A Q16665 1/20 0.58
POLB P06746 1/20 0.52
PDE7A Q13946 1/20 0.51
MAPT P10636 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 3/20 0.45
HTT P42858 3/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 2/20 0.43
AR P10275 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK1 P28482 1/20 0.43
PKM P14618 1/20 0.43
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL6585558 0.87 PDE7A (0.56) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL4427347 0.85 ALDH1A1 (0.55) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL1010657 0.85 ALDH1A1 (0.53) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL30619304 0.85 ALDH1A1 (0.53) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL1999857 0.84 PDE7A (0.54) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL10904597 0.83 ALDH1A1 (0.56) ALDH1A1HIF1APOLBPDE7AMAPT
SCHEMBL2718360 0.83 ALDH1A1 (0.56) ALDH1A1HIF1APOLBMAPTMEN1
SCHEMBL3207733 0.82 AR (0.53) ALDH1A1POLBPDE7AMAPTMEN1
SCHEMBL1284197 0.82 HSPB1 (0.58) ALDH1A1HIF1AMAPTMEN1KMT2A
SCHEMBL31138869 0.81 ALDH1A1 (0.53) ALDH1A1HIF1APOLBPDE7AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115663403-B High-flame-retardance diaphragm for lithium ion battery and preparation process of high-flame-retardance diaphragm 江苏厚生新能源科技股份有限公司 2025-06-24 CN claimed
CN-119143991-A Phenanthroline benzimidazole structure polyimide single rare earth ion coordination full spectrum luminescent material and preparation method and application thereof 中国科学院福建物质结构研究所 2024-12-17 CN claimed
CN-119101240-A Phenanthroline benzimidazole structure polyimide single rare earth ion coordination acid response data encryption material and preparation method and application thereof 中国科学院福建物质结构研究所 2024-12-10 CN claimed
CN-114106325-B Photosensitive resin, photoresist, preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2024-02-09 CN claimed
CN-114106326-B Photosensitive resin, photoresist, preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2023-12-05 CN claimed
CN-115663403-A High-flame-retardant diaphragm for lithium ion battery and preparation process thereof 江苏厚生新能源科技有限公司 2023-01-31 CN claimed
CN-115626988-A Non-coplanar benzocarbazole modified polyimide, and preparation method and application thereof 中国科学院福建物质结构研究所 2023-01-20 CN claimed
CN-111807964-B Preparation method of 4,4 '-dinitro-2,2' -bis (trifluoromethyl) diphenyl ether 天津众泰材料科技有限公司 2023-01-10 CN claimed
CN-115073332-A Asymmetric aromatic diamine monomer containing diphenyl sulfone and trifluoromethyl structure simultaneously, polyimide and polyimide film 常州大学 2022-09-20 CN claimed
CN-114106326-A Photosensitive resin, photoresist and preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2022-03-01 CN claimed
CN-114106325-A Photosensitive resin, photoresist and preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2022-03-01 CN claimed
CN-111807964-A Preparation method of 4,4 '-dinitro-2, 2' -bistrifluoromethyldiphenyl ether 天津市众泰化工科技有限公司 2020-10-23 CN claimed
US-9255065-B1 Multi(azobenzene-amine) photoactive crosslinkers and methods of making the same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2016-02-09 US claimed
US-8962890-B1 Multifunctional crosslinkers for shape-memory polyimides, polyamides and poly(amide-imides) and methods of making the same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2015-02-24 US claimed
CN-102766067-A Synthetic method of beflubutamid TAICANG YUNTONG CHEMICAL FACTORY 2012-11-07 CN claimed
CN-102731437-A Preparation method of 4-piperazine-3-trifluoromethylaniline hydrochloride CGENE TECH SUZHOU CHINA CO LTD 2012-10-17 CN claimed
CN-101337911-A Method for preparing 3-fluor-4-trifluoromethylbenzonitrile FUXIN CUSTCHEM FINE CHEMICAL C (CN) 2009-01-07 CN claimed
US-4470930-A Preparation of nuclear chlorinated aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-11 US claimed
WO-2026098560-A2 BENZENE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2026-05-15 WO disclosed
US-4031232-A 1-Alkyl-2-(phenoxymethyl)-5-nitro-imidazoles and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DT) 1977-06-21 US disclosed