SCHEMBL7633183

SCHEMBL7633183

ClC(Cl)(Cl)C=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.52
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.46
LMNA P02545 2/20 0.44
MAPK1 P28482 2/20 0.44
NFE2L2 Q16236 2/20 0.44
CYP19A1 P11511 2/20 0.44
MAOA P21397 2/20 0.44
TRPA1 O75762 2/20 0.44
ALOX5 P09917 1/20 0.44
MAPT P10636 2/20 0.42
RECQL P46063 2/20 0.42
HDAC3 O15379 1/20 0.42
TNKS O95271 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42

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
Acetic Acid SCHEMBL29016514 0.87 CYP2C19 (0.56) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL146716 0.80 MAOB (0.44) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL6054823 0.78 MAOB (0.52) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL8609025 0.77 TRPA1 (0.45) MAOBCYP2C19ALDH1A1NFE2L2TRPA1
SCHEMBL26917 0.76 CYP2C19 (0.55) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL3340845 0.76 MAOB (0.50) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL28939716 0.76 CYP2C19 (0.55) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL9800772 0.76 NFE2L2 (0.54) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL18903348 0.76 MAOB (0.50) MAOBCYP2C19ALDH1A1TSHRLMNA
SCHEMBL6286942 0.76 CYP2C19 (0.55) MAOBCYP2C19ALDH1A1TSHRLMNA

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-103611514-A Multifunctional adsorption particles capable of treating industrial organic wastewater with imbalance of nitrogen and phosphorus and preparation method thereof UNIV BEIJING NORMAL 2014-03-05 CN disclosed
EP-0905156-B1 Block copolymer, process for producing the same and resin composition of the same KURARAY CO (JP) 2002-01-16 EP disclosed
CN-1123546-A 4-arylisoindole analgesics ORTHO PHARMA CORP (US) 1996-05-29 CN disclosed
EP-0391913-A1 RADIATION SENSITIVE RESIST MATERIAL PLESSEY OVERSEAS LIMITED (GB) 1990-10-17 EP disclosed
WO-1990003601-A1 RADIATION SENSITIVE RESIST MATERIAL PLESSEY OVERSEAS LIMITED (GB) 1990-04-05 WO disclosed
US-4587203-A USING A DEVELOPMENT SOLVENT AND RINSING NONSOLVENT; SILANE COUPLING INTERLAYER; DIMENSIONAL STABILITY AND SHARPNESS OF IMAGE HUGHES AIRCRAFT COMPANY (US) 1986-05-06 US disclosed
US-4535054-A IRRADIATION TO GIVE NEGATIVE PATTERN IMAGE, DEVELOPMENT BY DISSOLUING UNEXPOSED POLYMER WITH SOLVENT AND RINSING HUGHES AIRCRAFT COMPANY (US) 1985-08-13 US disclosed
EP-0025159-B1 USE OF STYRENE POLYMERS FOR THE PREPARATION OF OPTICAL SYSTEM BAYER AG (DE) 1984-05-09 EP disclosed
US-4420225-A Lens of a homo- or copolymer of a fluorine containing styrene polymer BAYER AKTIENGESELLSCHAFT (DE) 1983-12-13 US disclosed
EP-0025159-A2 Use of styrene polymers for the preparation of optical system BAYER AG (DE) 1981-03-18 EP disclosed