SCHEMBL39834

SCHEMBL39834

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

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.71
MAOB P27338 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
NPSR1 Q6W5P4 1/20 0.60
SRD5A2 P31213 1/20 0.59
HTT P42858 1/20 0.58
RAB9A P51151 1/20 0.58
MAPT P10636 1/20 0.57
ALDH1A1 P00352 2/20 0.57
KCNK3 O14649 2/20 0.57
POLB P06746 2/20 0.57
KCNK9 Q9NPC2 1/20 0.56
LMNA P02545 2/20 0.56
P2RX1 P51575 1/20 0.56
AKR1C3 P42330 1/20 0.55
AKR1C2 P52895 1/20 0.55
HPGD P15428 1/20 0.54

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
SCHEMBL30093723 1.00 CES2 (0.71) CES2MAOBMEN1KMT2ANPSR1
Toluene SCHEMBL27952197 0.90 MEN1 (0.61) CES2MAOBMEN1KMT2ANPSR1
Acetoacetic Acid SCHEMBL27759778 0.87 CES2 (0.56) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL10612843 0.87 CES2 (0.56) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL21132592 0.86 ACHE (0.56) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL4656855 0.86 MAPT (0.78) MEN1KMT2ANPSR1HTTRAB9A
SCHEMBL935957 0.85 CES2 (0.79) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL2096723 0.85 CES2 (0.52) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL5738726 0.84 MAOB (0.62) CES2MAOBMEN1KMT2ANPSR1
SCHEMBL3176325 0.83 CES2 (1.00) CES2MAOBMEN1KMT2ANPSR1

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 1616 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119212782-A Preparation method of 3' - (trifluoromethyl) acetophenone (TFMAP) 迪帕克亚硝酸盐有限公司 2024-12-27 CN claimed
CN-118993932-A Efficient clean synthesis method of m-trifluoromethyl acetophenone oxime 辽宁众辉生物科技有限公司 2024-11-22 CN claimed
CN-118388332-A Preparation method of m-trifluoromethyl acetophenone 浙江予睿化学科技有限公司 2024-07-26 CN claimed
US-20240243010-A1 INHIBITOR FOR SELECTIVELY DEPOSITING THIN FILM AND METHOD FOR SELECTIVELY DEPOSITING THIN FILM ADEKA CORPORATION (JP) 2024-07-18 US 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-117820163-A Synthesis method of trifloxystrobin 山东华阳农药化工集团有限公司 2024-04-05 CN claimed
CN-115925527-B Method for preparing alpha-diaryl methyl substituted ketone compound 湖南理工学院 2024-02-09 CN claimed
WO-2023223105-A1 A PROCESS OF PREPARATION OF 3'-(TRIFLUOROMETHYL)ACETOPHENONE (TFMAP) DEEPAK NITRITE LIMITED (IN) 2023-11-23 WO claimed
US-20230369039-A1 METHOD OF MANUFACTURING SEMICONDUCTOR DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-11-16 US claimed
CN-116144617-A NADH dependent alcohol dehydrogenase CpSADH, coding gene, strain and application 浙江工业大学 2023-05-23 CN claimed
CN-1409697-A Process for production of trifluoromethylacetophenones BAYER AG (DE) 2003-04-09 CN claimed
WO-2003004666-A2 METHOD FOR THE ENANTIOSELECTIVE REDUCTION OF A PROCHIRAL AROMATIC KETONE COMPRISING AT LEAST ONE TRIFLUOROMETHYL GROUP ON THE AROMATIC CYCLE RHODIA CHIMIE (FR) 2003-01-16 WO claimed
EP-0993432-B1 PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL ACETOPHENONE BAYER AG (DE) 2002-10-09 EP claimed
EP-1240127-A1 PROCESS FOR THE PRODUCTION OF TRIFLUOROMETHYLACETOPHENONES Bayer Aktiengesellschaft (DE) 2002-09-18 EP claimed
US-6420608-B1 REACTION OF VINYL ETHER OR VINYL AMIDE WITH HALOGENATED AROMATIC COMPOUND BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 US claimed
WO-2001044152-A1 PROCESS FOR THE PRODUCTION OF TRIFLUOROMETHYLACETOPHENONES BAYER AKTIENGESELLSCHAFT (DE) 2001-06-21 WO claimed
EP-0993432-A1 PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL ACETOPHENONE Novartis AG (CH) 2000-04-19 EP claimed
WO-2000018714-A1 METHOD FOR ARYLATION OF ACETOPHENONE TYPE COMPOUNDS RHODIA CHIMIE (FR) 2000-04-06 WO claimed
US-5969188-A Process for producing trifluoromethylacetophenones NIPA HARDWICKE, INC. (US) 1999-10-19 US claimed
WO-1998058895-A1 PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL ACETOPHENONE NOVARTIS AG (CH) 1998-12-30 WO claimed