SCHEMBL147032

SCHEMBL147032

CCc1ccc(C(Cl)Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.67
MAPK1 P28482 1/20 0.67
ATM Q13315 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
TP53 P04637 1/20 0.43
TAAR1 Q96RJ0 1/20 0.42
CYP2A6 P11509 1/20 0.41
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
MGLL Q99685 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CA2 P00918 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 2/20 0.37
PLAU P00749 1/20 0.37
AKR1C3 P42330 1/20 0.36

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
SCHEMBL25662434 0.93 TSHR (0.59) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL8750481 0.82 TSHR (0.64) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL28734969 0.80 TSHR (0.68) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL117710 0.80 TSHR (1.00) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL8094364 0.80 TSHR (0.45) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL11270656 0.78 TSHR (0.59) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL2491929 0.78 TSHR (0.58) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL8089660 0.77 ALDH1A1 (0.52) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL29262161 0.77 L3MBTL1 (0.57) TSHRMAPK1ATMTDP1L3MBTL1
SCHEMBL28650496 0.77 L3MBTL1 (0.57) TSHRMAPK1ATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111909379-B Preparation method of thioether polymer 江汉大学 2022-09-20 CN claimed
CN-111187218-B Application of 1-substituted-1H-imidazole-2-carboxylic acid compound in preparation of metal beta-lactamase inhibitor 四川大学 2023-08-04 CN disclosed
CN-111253317-B 1-substituted-1H-imidazole-2-carboxylic acid compound 四川大学 2023-08-04 CN disclosed
CN-112250866-B Preparation method of free radical type photocuring resin with thioether as main chain 江汉大学 2023-04-07 CN disclosed
CN-111909379-B Preparation method of thioether polymer 江汉大学 2022-09-20 CN disclosed
CN-110551146-B Continuous preparation method of benzyl zinc halide and derivatives thereof 凯莱英医药集团(天津)股份有限公司 2022-02-22 CN disclosed
CN-112250866-A Preparation method of free radical type photocuring resin with thioether as main chain 江汉大学 2021-01-22 CN disclosed
CN-111909379-A Preparation method of thioether polymer 江汉大学 2020-11-10 CN disclosed
CN-110551146-A Continuous preparation method of benzyl zinc halide and derivatives thereof ASYMCHEM LAB TIANJIN CO LTD 2019-12-10 CN disclosed
CN-109111463-A The manufacturing method of aromatic compound DIC株式会社 2019-01-01 CN disclosed
US-20120059137-A1 MONODISPERSE CHLOROMETHYLSTYRENE POLYMER AND PRODUCING METHOD THEREOF AGC SEIMI CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
EP-0849253-B1 Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL CO (JP) 2001-05-16 EP disclosed
EP-1053990-A2 A method of producing an aromatic ketone and an aromatic ketone composition containing it TORAY INDUSTRIES, INC. (JP) 2000-11-22 EP disclosed
US-5872291-A Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-02-16 US disclosed
EP-0849253-A1 Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-06-24 EP disclosed
EP-0150169-B1 A PROCESS FOR PREPARING SUBSTITUTED BENZOTRICHLORIDE COMPOUNDS Monsanto Company (US) 1987-11-11 EP disclosed
US-4593144-A REACTING SUBSTITUTED BENZAL CHLORIDES WITH PRECHLOROALKANE IN PRESENCE OF BASE AND PHASE TRANSFER CATALYST MONSANTO COMPANY (US) 1986-06-03 US disclosed
EP-0150169-A2 A process for preparing substituted benzotrichloride compounds Monsanto Company (US) 1985-07-31 EP disclosed