SCHEMBL8196751

SCHEMBL8196751

Clc1ccc(CCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.58
MAOA P21397 2/20 0.56
MAOB P27338 2/20 0.56
TAAR1 Q96RJ0 2/20 0.56
TSHR P16473 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 2/20 0.50
PLAAT3 P53816 2/20 0.50
PLAAT5 Q96KN8 2/20 0.50
PLAAT2 Q9NWW9 2/20 0.50
PLAAT4 Q9UL19 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
FFAR1 O14842 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
CASP1 P29466 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
Ammonia Solution, Strong SCHEMBL11188168 0.97 SIGMAR1 (0.56) SIGMAR1MAOAMAOBTAAR1TSHR
SCHEMBL14219298 0.93 CYP1A2 (0.64) SIGMAR1MAOAMAOBTAAR1MEN1
SCHEMBL10812127 0.90 HTR2A (0.60) SIGMAR1MAOAMAOBTAAR1MEN1
SCHEMBL2135113 0.88 TAAR1 (0.68) MAOBTAAR1LMNAALOX15
SCHEMBL12040532 0.87 MAOB (0.58) SIGMAR1MAOAMAOBALDH1A1PLAAT3
SCHEMBL8723191 0.87 MAOB (0.58) SIGMAR1MAOAMAOBALDH1A1PLAAT3
SCHEMBL13658171 0.87 NR1D1 (0.51) SIGMAR1MAOAMAOBTAAR1MEN1
SCHEMBL11855324 0.87 MEN1 (0.47) SIGMAR1MAOAMAOBTAAR1MEN1
SCHEMBL55138 0.85 MAOB (0.72) SIGMAR1MAOAMAOBTAAR1ALDH1A1
SCHEMBL12506236 0.85 MAOB (0.72) SIGMAR1MAOAMAOBTAAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101735116-B Sulfonated aromatic diamine and sulfonated polyimide resin and preparation methods thereof CHINESE ACAD INST CHEMISTRY 2013-08-07 CN claimed
CN-103130592-A Synthetic method for diaryl methane derivatives UNIV CHONGQING 2013-06-05 CN claimed
CN-101735116-A Sulfonated aromatic diamine and sulfonated polyimide resin and preparation methods thereof CHINESE ACAD INST CHEMISTRY 2010-06-16 CN claimed
CN-114345370-B Method for reduction cross coupling of photocatalytic aromatic olefin and halogenated hydrocarbon 陕西师范大学 2023-07-21 CN disclosed
CN-111704548-B Method for preparing nitroolefin from aryl ethane and nitrate 郑州师范学院 2023-04-25 CN disclosed
CN-114591138-A Preparation method of bibenzyl compound 青岛伯川特聚科技有限公司 2022-06-07 CN disclosed
CN-114345370-A Method for reducing and cross-coupling aromatic olefin and halogenated hydrocarbon through photocatalysis 陕西师范大学 2022-04-15 CN disclosed
CN-113660983-A Carbamate derivatives and uses thereof 诺瑟拉有限公司 2021-11-16 CN disclosed
WO-2020198464-A1 HIGHLY SELECTIVE ELECTROCHEMICAL HYDROGENATION OF ALKYNES THE TRUSTEES OF INDIANA UNIVERSITY (US) 2020-10-01 WO disclosed
CN-111704548-A Method for preparing nitroolefin from aryl ethane and nitrate 郑州师范学院 2020-09-25 CN disclosed
WO-2020012403-A1 AN IMPROVED PROCESS FOR DIASTER-EOSELECTIVE SYNTHESIS OF VICINAL DIAMINES Piramal Enterprises Limited (IN) 2020-01-16 WO disclosed
EP-0723525-A4 PROCESS FOR DECREASING CHLORINE CONTENT IN CHLORINATED HYDROCARBONS UNIV PRINCETON (US) 1996-09-25 EP disclosed
EP-0723525-A1 PROCESS FOR DECREASING CHLORINE CONTENT IN CHLORINATED HYDROCARBONS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1996-07-31 EP disclosed
WO-1995010484-A1 PROCESS FOR DECREASING CHLORINE CONTENT IN CHLORINATED HYDROCARBONS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1995-04-20 WO disclosed
US-5159117-A Reacting ketone or aldehyde with nitrites in presence of acid catalyst BASF AKTIENGESELLSCHAFT (DE) 1992-10-27 US disclosed
EP-0472118-A1 Process for production of alpha,alpha-dialkoxycetones BASF Aktiengesellschaft (DE) 1992-02-26 EP disclosed
US-4431660-A UROGENITAL DISORDERS; ENZYME INHIBITORS; KIDNEY AND BLADDER STONES MERCK & CO., INC. (US) 1984-02-14 US disclosed
EP-0021228-B1 4-SUBSTITUTED-3-HYDROXY-3-PYRROLINE-2,5-DIONE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME MERCK & CO. INC. (US) 1982-09-01 EP disclosed
US-4256758-A 4-Substituted-3-hydroxy-3-pyrroline-2,5-dione inhibitors of glycolic acid oxidase MERCK & CO., INC. (US) 1981-03-17 US disclosed
EP-0021228-A1 4-Substituted-3-hydroxy-3-pyrroline-2,5-dione compounds, process for their preparation and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-01-07 EP disclosed