SCHEMBL5701503

SCHEMBL5701503

O=C=C=Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
CYP2A6 P11509 1/20 0.43
TSHR P16473 2/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 5/20 0.37
MAPK1 P28482 2/20 0.37
TRPA1 O75762 1/20 0.37
ALOX5 P09917 1/20 0.37
HDAC3 O15379 3/20 0.37
HDAC4 P56524 3/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
HDAC8 Q9BY41 3/20 0.37
HDAC6 Q9UBN7 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
HDAC7 Q8WUI4 2/20 0.36
HDAC10 Q969S8 2/20 0.36
HDAC11 Q96DB2 2/20 0.36
HDAC9 Q9UKV0 2/20 0.36
HDAC5 Q9UQL6 2/20 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
Water SCHEMBL27514949 0.97 ALDH1A1 (0.42) ALDH1A1CYP2A6TSHRMAOBLMNA
Ammonia Solution, Strong SCHEMBL9795266 0.80 ALDH1A1 (0.43) ALDH1A1CYP2A6TSHRMAOBLMNA
SCHEMBL175717 0.78
SCHEMBL10606504 0.76 ALDH1A1 (0.46) ALDH1A1CYP2A6TSHRMAOBLMNA
Hydrogen Peroxide SCHEMBL28772659 0.76 ALDH1A1 (0.46) ALDH1A1CYP2A6TSHRMAOBLMNA
SCHEMBL28455431 0.76 ALDH1A1 (0.46) ALDH1A1CYP2A6TSHRMAOBLMNA
SCHEMBL15346317 0.75 ALDH5A1 (0.48) ALDH1A1MAOBLMNAHDAC3HDAC4
SCHEMBL4333668 0.74 ALDH1A1 (0.38) ALDH1A1CYP2A6TSHRMAOBLMNA
SCHEMBL1178413 0.74 ALDH1A1 (0.43) ALDH1A1CYP2A6TSHRMAOBLMNA
SCHEMBL15346478 0.73 CCNB2 (0.48) ALDH1A1MAOBLMNAL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10551674-B2 Optical film and liquid crystal display SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-02-04 US claimed
CN-110437106-A Aryl amidine compound and its synthetic method UNIV GUANGDONG PHARM 2019-11-12 CN claimed
US-20170153478-A1 OPTICAL FILM AND LIQUID CRYSTAL DISPLAY SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-06-01 US claimed
CN-103364381-B For detecting the method for the defect in inorganic-coated polymer surfaces LIFE TECHNOLOGIES, INC. (US) 2016-04-06 CN claimed
CN-104788274-A Preparation method of chiral 1, 3-butadiene-2-secondary alcohol UNIV WUHAN TECH 2015-07-22 CN claimed
CN-103364381-A Methods for detecting defects in inorganic-coated polymer surfaces LIFE TECHNOLOGIES CORP 2013-10-23 CN claimed
CN-101885832-B Preparation and application of latent nonionic self-emulsifying epoxy curing agent GUANGZHOU CHEMICAL GROUTING CO LTD CHINESE ACADEMY OF SCIENCES 2012-10-03 CN claimed
CN-101045759-B Styrene or substituted styrene polymer type quaternary ammonium salt antistat or bacterial agent and preparation method thereof DINGLAN GREEN CHEMICAL INST CO LTD CHANGZHOU 2011-06-01 CN claimed
CN-101885832-A Preparation and application of latent nonionic self-emulsifying epoxy curing agent CAS GUANGZHOU HUAGUAN ENGINEERING CO LTD 2010-11-17 CN claimed
CN-101775196-A Preparation method of novel quinone amine curing agent and application to normal temperature epoxy curing system CAS GUANGZHOU HUAGUAN ENGINEER 2010-07-14 CN claimed
CN-100523009-C Photoinitiator in benzophenone type of cinnamene oligomer substitution, and preparation method DINGLAN GREEN CHEMICAL INST CO (CN) 2009-08-05 CN claimed
CN-101045759-A Styrene or substituted styrene polymer type quaternary ammonium salt antistat or bacterial agent and preparation method thereof DINGLAN GREEN CHEMICAL INST CO (CN) 2007-10-03 CN claimed
CN-101003583-A Photoinitiator in benzophenone type of cinnamene oligomer substitution, and preparation method DINGLAN GREEN CHEMICAL INST CO (CN) 2007-07-25 CN claimed
CN-118435400-A Polymer electrolyte membrane based on polymer having high-density acidic functional groups 国立大学法人东海国立大学机构 2024-08-02 CN disclosed
CN-113924077-A Cerium (III) carbonate formulations 加利福尼亚大学董事会 2022-01-11 CN disclosed
WO-2020189234-A1 ELECTRON BEAM CURABLE PRINTING INK COMPOSITION AND ELECTRON BEAM CURABLE OVERPRINT VARNISH COMPOSITION サカタインクス株式会社 2020-09-24 WO disclosed
EP-0444210-B1 ARYLSTYRENE POLYMER AND COPOLYMER AND PROCESS FOR PREPARING THE SAME IDEMITSU KOSAN CO (JP) 1995-05-24 EP disclosed
US-5403908-A Aryl styrene-based copolymer IDEMITSU KOSAN COMPANY, LIMITED (JP) 1995-04-04 US disclosed
EP-0534249-A2 Process for the preparation of 3-phenyl-2-propenones NIHON BAYER AGROCHEM K.K. (JP) 1993-03-31 EP disclosed
EP-0444210-A1 ARYLSTYRENE POLYMER AND COPOLYMER AND PROCESS FOR PREPARING THE SAME IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-09-04 EP disclosed