SCHEMBL169124

SCHEMBL169124

Cc1ccccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
ACHE P22303 2/20 0.47
HSD11B1 P28845 5/20 0.47
TDP1 Q9NUW8 4/20 0.43
ALDH1A1 P00352 4/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
AR P10275 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
SCN8A Q9UQD0 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL29656610 1.00 TSHR (0.47) TSHRACHEHSD11B1TDP1ALDH1A1
Bromide SCHEMBL28214529 0.97 HSD11B1 (0.45) TSHRACHEHSD11B1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL27874688 0.97 TDP1 (0.46) TSHRACHEHSD11B1TDP1ALDH1A1
Ammonia Solution, Strong SCHEMBL1870627 0.97 HSD11B1 (0.45) TSHRACHEHSD11B1TDP1ALDH1A1
Fluoride SCHEMBL27976646 0.97 HSD11B1 (0.45) TSHRACHEHSD11B1TDP1ALDH1A1
Acetonitrile SCHEMBL10788322 0.89 AR (0.47) TSHRACHEHSD11B1TDP1ALDH1A1
SCHEMBL25951815 0.83 ACHE (0.47) TSHRACHEHSD11B1TDP1ALDH1A1
SCHEMBL11623026 0.83 ACHE (0.47) TSHRACHEHSD11B1TDP1ALDH1A1
SCHEMBL9568248 0.83 MEN1 (0.43) TSHRHSD11B1TDP1ALDH1A1KDM4E
SCHEMBL10034988 0.81 ACHE (0.45) TSHRACHEHSD11B1TDP1ALDH1A1

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

Appears in 3079 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120054584-A Z-type CdS@g-C3N4At benzyl and aliphatic sp3C-H activation and CO2Application of photocatalytic carboxylation 重庆工商大学 2025-05-30 CN claimed
CN-119263967-A Chiral cis-cyclobutane derivative and method for preparing same by taking weak polarized olefin as substrate 华侨大学 2025-01-07 CN claimed
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 EP claimed
US-12027670-B2 Non-aqueous electrolyte solution and lithium secondary battery including the same LG ENERGY SOLUTION, LTD. (KR) 2024-07-02 US claimed
CN-117924087-A Safe and environment-friendly preparation method of dinitroaromatic hydrocarbon 福州大学 2024-04-26 CN claimed
US-20240136585-A1 ELECTROLYTES FOR LITHIUM-CONTAINING BATTERY CELLS APPLE INC. (US) 2024-04-25 US claimed
CN-116063209-B Method for preparing benzylamine derivative by catalyzing amination of benzyl C-H bond through nickel under promotion of visible light 上海沃凯生物技术有限公司 2024-04-09 CN claimed
CN-117843494-A Method for preparing 2-methyl-3-trifluoromethyl aniline 和鼎(南京)医药技术有限公司 2024-04-09 CN claimed
US-11881558-B2 Electrolytes for lithium-containing battery cells APPLE INC. (US) 2024-01-23 US claimed
EP-4273147-A1 SUBSTITUTED SPIROLACTAMS, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2023-11-08 EP claimed
EP-1147079-A2 BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS Bayer Aktiengesellschaft (DE) 2001-10-24 EP claimed
CN-1289069-A Photo-resist composition containing photo-alkali-generator and photo-acid-generator HYUNDAI ELECTRONICS IND (KR) 2001-03-28 CN claimed
WO-2000041469-A2 β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2000-07-20 WO claimed
US-6060453-A Immunomodulatory, anti-inflammatory, and anti-proliferative compounds: 5,6-dideoxy, 5-amino derivatives of idose and 6-deoxy, 6-amino derivatives of glucose GREENWICH PHARMACEUTICALS INCORPORATED (US) 2000-05-09 US claimed
US-5908581-A FLUORESCENT MATERIAL EASTMAN KODAK COMPANY (US) 1999-06-01 US claimed
US-5126497-A Catalyst and process for the preparation of trifluoromethyltoluenes OCCIDENTAL CHEMICAL CORPORATION (US) 1992-06-30 US claimed
US-4849557-A Preparation of trifluoromethyltoluene from halomethylbenzotrifluoride CENTRAL GLASS COMPANY, LIMITED (JP) 1989-07-18 US claimed
US-4588844-A Process for preparing aromatic aldehydes BAYER AKTIENGESELLSCHAFT (DE) 1986-05-13 US claimed
EP-0034731-B1 TRIFLUOROMETHYLBENZYLIC ESTERS, THEIR INTERMEDIATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES BAYER AG (DE) 1985-10-30 EP claimed
US-4436941-A Process for the isomerization of alkylbenzotrifluorides BAYER AKTIENGESELLSCHAFT (DE) 1984-03-13 US claimed