SCHEMBL219676

SCHEMBL219676

O=C(OC(F)(F)F)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
F2 P00734 1/20 0.56
TSHR P16473 4/20 0.52
CES1 P23141 3/20 0.52
MAPK1 P28482 1/20 0.50
HIF1A Q16665 1/20 0.50
TDP1 Q9NUW8 4/20 0.48
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 1/20 0.48
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 4/20 0.45
KMT2A Q03164 4/20 0.45
POLB P06746 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
CES2 O00748 2/20 0.44

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
Hydrochloric Acid SCHEMBL6620902 0.98 LMNA (0.54) LMNAF2TSHRCES1MAPK1
SCHEMBL28123902 0.98 LMNA (0.54) LMNAF2TSHRCES1MAPK1
SCHEMBL6398909 0.89 MAPK1 (0.46) LMNAF2TSHRCES1MAPK1
SCHEMBL10859570 0.88 CES2 (0.41) LMNAF2TSHRCES1TDP1
SCHEMBL27988380 0.88 PDCD1 (0.53) LMNAF2HIF1ACYP1A2MAPT
SCHEMBL29167939 0.86 CES2 (0.39) LMNAF2CES1TDP1TP53
SCHEMBL11442093 0.86 LMNA (0.42) LMNAF2TSHRCES1MAPK1
SCHEMBL29894307 0.84 TSHR (0.52) TSHRCES1ALDH1A1HSD17B10TP53
SCHEMBL8531480 0.84 TSHR (0.52) TSHRCES1ALDH1A1HSD17B10TP53
SCHEMBL28966125 0.83 LMNA (0.53) LMNACES1MAPK1HIF1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4698531-A1 PYRROLOPYRAZINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF Sanofi (FR) 2026-02-25 EP claimed
EP-4558500-A1 IMIDAZOPYRIDINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF Sanofi (FR) 2025-05-28 EP claimed
CN-119486565-A Perovskite precursor solution, perovskite solar cell, preparation method and photovoltaic module 天合光能股份有限公司 2025-02-18 CN claimed
US-20240389450-A1 LIGHT EMITTING ELEMENT, PRODUCTION METHOD FOR LIGHT EMITTING ELEMENT, DISPLAY DEVICE, AND PRODUCTION METHOD FOR DISPLAY DEVICE Sharp Display Technology Corporation (JP) 2024-11-21 US claimed
WO-2024218235-A1 PYRROLOPYRAZINE COMPOUNDS, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-10-24 WO claimed
CN-118206441-A Preparation method of trifluoromethyl benzoic acid 黑龙江邦普生物科技有限公司 2024-06-18 CN claimed
CN-110099905-B Substituted pyrazoloazepin-8-ones and their use as phosphodiesterase inhibitors 联合疗法公司 2024-06-14 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-110088108-B Substituted pyrazoloazepin-4-ones and their use as phosphodiesterase inhibitors 联合疗法公司 2024-06-14 CN claimed
CN-117976891-A Lithium battery negative electrode material, negative electrode plate and preparation method and application thereof 中国石油化工股份有限公司 2024-05-03 CN claimed
CN-1142131-C Process for preparing meta-(trifluoromethyl)benzoic acid 上海试四赫维化工有限公司 2004-03-17 CN claimed
CN-1356306-A Process for preparing meta-(trifluoromethyl)benzoic acid SHISI HEWEI CHEMICAL CO LTD SH (CN) 2002-07-03 CN claimed
WO-2001034199-A2 ONCOLYTIC COMBINATIONS FOR THE TREATMENT OF CANCER ELI LILLY AND COMPANY (US) 2001-05-17 WO claimed
CN-1270598-A Methods and compounds for analyzing nucleic acids by mass spectrometry RAPIGENE INC (US) 2000-10-18 CN claimed
CN-1212019-A Methods and compositions for detecting ligand pair binding using non-fluorescent labels RAPIGENE INC (US) 1999-03-24 CN claimed
CN-1212021-A Method and compositions for determining sequence of nucleic acid molecules RAPIGENE INC (US) 1999-03-24 CN claimed
CN-1108640-A lithiation of 1,3-bis(trifluoromethyl)benzene HOFFMANN LA ROCHE (CH) 1995-09-20 CN claimed
US-5219477-A Containing organometallic salts and inorganic metal borates; fromo reactinmetal hydroxide with phenols or aromatic carboxylic acid THE DOW CHEMICAL COMPANY (US) 1993-06-15 US claimed
US-4921950-A Preparation of 3'azido-3-'-deoxythymidine BURROUGHS WELLCOME CO. (US) 1990-05-01 US claimed
EP-0092627-B1 PROCESS FOR THE PREPARATION OF DI- OR TRIFLUOROMETHOXYPHENYL KETONES OR OF DI- OR TRIFLUOROMETHYLTHIOPHENYL KETONES RHONE-POULENC CHIMIE (FR) 1985-05-29 EP claimed