SCHEMBL4847445

SCHEMBL4847445

O=C(O)c1ccc(Cl)c(Cl)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
ALDH1A1 P00352 3/20 0.47
TP53 P04637 1/20 0.47
CASP1 P29466 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
KDM4E B2RXH2 3/20 0.42
ASPH Q12797 1/20 0.42
KDM8 Q8N371 1/20 0.42
CYP1A2 P05177 1/20 0.42
CLCN2 P51788 2/20 0.42
TDP1 Q9NUW8 2/20 0.41
MYC P01106 1/20 0.41
NR4A1 P22736 1/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
CTSB P07858 1/20 0.41
ADRA2A P08913 1/20 0.41

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
SCHEMBL20721983 0.84 HPGD (0.55) TSHRALDH1A1TP53CASP1SMN1; SMN2
Hydrochloric Acid SCHEMBL9860913 0.83 HPGD (0.53) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL7938468 0.83 ALDH1A1 (0.43) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL107955 0.83 TSHR (0.52) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL29488311 0.83 TSHR (0.47) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL364951 0.83 TSHR (0.47) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL27775492 0.81 KMT2A (0.50) TSHRALDH1A1CASP1KDM4ECLCN2
SCHEMBL28580395 0.81 TSHR (0.50) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL29886586 0.79 TSHR (0.64) TSHRALDH1A1TP53CASP1SMN1; SMN2
SCHEMBL432644 0.79 TSHR (0.64) TSHRALDH1A1TP53CASP1SMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402055-B Resource utilization method of 2, 4-dichloro-5-fluoroacetophenone mother liquor 浙江吉泰新材料股份有限公司 2024-10-29 CN claimed
CN-117402055-A Resource utilization method of 2, 4-dichloro-5-fluoroacetophenone mother liquor 浙江吉泰新材料股份有限公司 2024-01-16 CN claimed
CN-117402055-B Resource utilization method of 2, 4-dichloro-5-fluoroacetophenone mother liquor 浙江吉泰新材料股份有限公司 2024-10-29 CN disclosed
CN-117402055-A Resource utilization method of 2, 4-dichloro-5-fluoroacetophenone mother liquor 浙江吉泰新材料股份有限公司 2024-01-16 CN disclosed
EP-3074377-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2016-10-05 EP disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 WO disclosed
US-7371866-B2 Preparation of aromatic and heteroaromatic carboxylic acids by catalytic ozonolysis DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2008-05-13 US disclosed
WO-2005063385-A1 METHOD FOR OXIDIZING SATURATED HYDROCARBONS DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2005-07-14 WO disclosed
WO-2004067490-A2 USE OF INDIUM BENZOATES AS ACYLATION CATALYSTS ARKEMA (FR) 2004-08-12 WO disclosed
US-20030216577-A1 Preparation of aromatic and heteroaromatic carboxylic acids by catalytic ozonolysis DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) 2003-11-20 US disclosed
EP-1362840-A1 Process for the preparation of aromatic and heteroaromatic carboxylic acids via catalytic ozonolysis DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2003-11-19 EP disclosed