SCHEMBL19310

SCHEMBL19310

O=C(Cl)c1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.71
SRD5A2 P31213 1/20 0.59
LMNA P02545 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
P2RX1 P51575 1/20 0.56
POLB P06746 2/20 0.54
HPGD P15428 1/20 0.54
MAPT P10636 1/20 0.53
ALDH1A1 P00352 2/20 0.53
MAOB P27338 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KCNK3 O14649 1/20 0.53
KCNQ3 O43525 1/20 0.52
KCNQ2 O43526 1/20 0.52
KCNE1 P15382 1/20 0.52
KCNQ1 P51787 1/20 0.52
PTGS1 P23219 1/20 0.51
CNR1 P21554 1/20 0.51
TLR7 Q9NYK1 1/20 0.51

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
SCHEMBL29425720 1.00 CES2 (0.71) CES2SRD5A2LMNANPSR1P2RX1
Ethane SCHEMBL27364386 0.96 CES2 (0.67) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL7729073 0.90 KCNK3 (0.63) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL5349991 0.85 CES2 (0.52) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL11725067 0.85 CES2 (0.79) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL8775382 0.85 CES2 (0.52) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL2012089 0.84 MAPT (0.76) LMNAP2RX1POLBMAPTMEN1
SCHEMBL1019311 0.84 CES2 (0.53) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL3176325 0.83 CES2 (1.00) CES2SRD5A2LMNANPSR1P2RX1
SCHEMBL1237189 0.83 SRD5A2 (0.79) CES2SRD5A2LMNANPSR1P2RX1

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 2665 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120020114-A Preparation method of N-alkenyl amide compound 中国石油化工股份有限公司 2025-05-20 CN claimed
CN-120020115-A Process for the preparation of N- (alkyl-2-hydroxy) alkylamides and N-alkenylamides 中国石油化工股份有限公司 2025-05-20 CN claimed
CN-117384167-A Dihydropyrimidine [4,5-d ] pyrimidine-2 (H) -ketone Nrf2 activator and preparation method and application thereof 寒武智元(南京)生物医药科技有限公司 2024-01-12 CN claimed
CN-117343077-A Isoindolinone morpholine derivative and preparation method and application thereof 南开大学 2024-01-05 CN claimed
CN-114736354-B Preparation method and application of resveratrol-based all-bio-based epoxy resin 中科院广州化学有限公司 2023-09-12 CN claimed
CN-114195772-B 1,2, 4-oxadiazole derivative containing 1,3, 4-thiadiazole unit, and preparation method and application thereof 贵州大学 2023-06-30 CN claimed
CN-115399179-A Application of polysaccharide-based cationic polymer in prevention and treatment of soil-borne diseases of agriculture and forestry 中国科学院化学研究所 2022-11-29 CN claimed
CN-114736354-A Preparation method and application of resveratrol-based all-bio-based epoxy resin 中科院广州化学有限公司 2022-07-12 CN claimed
CN-111662275-A Benzenesulfonamide IDH mutant inhibitor, preparation method and application thereof 中国药科大学 2020-09-15 CN claimed
US-20190350903-A1 INDOMETHACIN ANALOGS FOR THE TREATMENT OF CASTRATE-RESISTANT PROSTATE CANCER VANDERBILT UNIVERSITY (US) 2019-11-21 US claimed
EP-0666260-B1 3-(2-aminoethyl)-4-3-(trifluoromethyl)benzoyl-3,4-dihydro-2H-1,4-benzoxazine derivatives, their preparation and use in therapy SYNTHELABO (FR) 1999-08-04 EP claimed
EP-0639559-B1 Preparation of 1,2-diacyl-2-(t-alkyl)hydrazines ROHM & HAAS (US) 1997-10-15 EP claimed
CN-1109880-A 3-(2-aminoethyl)-4-[3-(trifluoromethyl) benzoyl]-3,4-dihydro-1,4-benzoxazine derivative and preparation of same SYNTHELABO (FR) 1995-10-11 CN claimed
EP-0639559-A1 Preparation of 1,2-diacyl-2-(t-alkyl)hydrazines ROHM AND HAAS COMPANY (US) 1995-02-22 EP claimed
WO-1993014055-A1 PREPARATION OF 2,5-DICHLOROBENZOPHENONES MAXDEM INCORPORATED (US) 1993-07-22 WO claimed
US-5210313-A Friedel crafts aryloylation of 1,4-dichlorobenzene and Lewis acids MAXDEM INCORPORATED (US) 1993-05-11 US claimed
US-4581179-A Process for the preparation of trifluoromethylbenzoyl chlorides and bromides from trifluoromethylbenzoyl fluorides OCCIDENTAL CHEMICAL CORPORATION (US) 1986-04-08 US claimed
US-4500471-A REACTING TRICHLORO-OR TRIBROMOMETHYLBENZOYL HALIDES WITH HYDROGEN FLORIDE OCCIDENTAL CHEMICAL CORPORATION (US) 1985-02-19 US claimed
EP-0038223-B1 PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYLBENZOYL HALIDES OCCIDENTAL CHEMICAL CORPORATION (US) 1984-08-08 EP claimed
EP-0038223-A1 Process for the preparation of trifluoromethylbenzoyl halides OCCIDENTAL CHEMICAL CORPORATION (US) 1981-10-21 EP claimed