Chlorobenzene

Chlorobenzene

SCHEMBL28035530

CC(CC(C)c1ccccc1C(=O)O)c1ccccc1C(=O)O.Clc1ccccc1

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.45
ALDH1A1 P00352 7/20 0.44
KMT2A Q03164 4/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 1/20 0.42
MEN1 O00255 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL28035959 0.92 ALDH1A1 (0.44) ALDH1A1KMT2AGAATDP1NPC1
Isopropylbenzene SCHEMBL28035524 0.87 ALDH1A1 (0.46) ALDH1A1KMT2AGAATDP1ALOX15
Isobutylbenzene SCHEMBL28035953 0.81 DHODH (0.45) ALDH1A1KMT2AGAATDP1CYP1A2
M-Xylene SCHEMBL28035950 0.81 POLB (0.50) ALDH1A1KMT2AGAATDP1ALOX15
Tert-Butylbenzene SCHEMBL28278111 0.81 HCAR2 (0.42) ALDH1A1KMT2AGAATDP1ALOX15
SCHEMBL28035522 0.80 POLB (0.43) KMT2AMEN1CYP1A2CYP2C19NPC1
SCHEMBL20555850 0.79 ACE2 (0.50) ALDH1A1KMT2AGAATDP1ALOX15
SCHEMBL21961149 0.79 TSHR (0.57) ALDH1A1KMT2AGAATDP1ALOX15
SCHEMBL1904536 0.79 TSHR (0.57) ALDH1A1KMT2AGAATDP1ALOX15
SCHEMBL5230221 0.79 ACE2 (0.50) ALDH1A1KMT2AGAATDP1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107868152-A A kind of catalytic component, catalyst and its application for olefinic polymerization 中国石油化工股份有限公司 2018-04-03 CN claimed
CN-107868153-A A kind of catalytic component, catalyst and its application for olefinic polymerization 中国石油化工股份有限公司 2018-04-03 CN claimed
CN-105085726-B A kind of catalytic component and catalyst for olefinic polymerization 中国石油化工股份有限公司 2017-11-07 CN claimed
CN-105085746-A Catalyst component for propylene polymerization, and catalyst thereof CHINA PETROLEUM & CHEMICAL 2015-11-25 CN claimed
CN-105085726-A Catalyst component for olefin polymerization, and catalyst for olefin polymerization CHINA PETROLEUM & CHEMICAL 2015-11-25 CN claimed
CN-107868152-A A kind of catalytic component, catalyst and its application for olefinic polymerization 中国石油化工股份有限公司 2018-04-03 CN disclosed
CN-107868153-A A kind of catalytic component, catalyst and its application for olefinic polymerization 中国石油化工股份有限公司 2018-04-03 CN disclosed
CN-105085726-B A kind of catalytic component and catalyst for olefinic polymerization 中国石油化工股份有限公司 2017-11-07 CN disclosed
CN-105085746-A Catalyst component for propylene polymerization, and catalyst thereof CHINA PETROLEUM & CHEMICAL 2015-11-25 CN disclosed
CN-105085726-A Catalyst component for olefin polymerization, and catalyst for olefin polymerization CHINA PETROLEUM & CHEMICAL 2015-11-25 CN disclosed