SCHEMBL669706

SCHEMBL669706

C=CC(=O)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.56
CES2 O00748 1/20 0.56
AKR1B1 P15121 1/20 0.56
AKT1 P31749 1/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
ALDH1A1 P00352 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MAPK1 P28482 1/20 0.45
CTBP2 P56545 1/20 0.45
EPHX2 P34913 1/20 0.45
CYP2C19 P33261 1/20 0.44
PAM P19021 2/20 0.44
TSHR P16473 2/20 0.43

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 SCHEMBL11111905 0.98 CES1 (0.54) CES1CES2AKR1B1AKT1MEN1
Oxalic Acid SCHEMBL29268820 0.96 CES1 (0.52) CES1CES2AKR1B1AKT1MEN1
SCHEMBL12811177 0.92 LMNA (0.48) CES1CES2AKR1B1AKT1MEN1
SCHEMBL29061794 0.90 CES1 (0.47) CES1CES2AKR1B1AKT1MEN1
SCHEMBL12836715 0.88 LMNA (0.62) CES1CES2AKT1MEN1KMT2A
SCHEMBL14410123 0.83 ALDH1A1 (0.42) CES1CES2AKR1B1AKT1MEN1
SCHEMBL20733435 0.83 ALDH1A1 (0.42) CES1CES2AKR1B1AKT1MEN1
SCHEMBL12810921 0.83 SRD5A2 (0.57) EPHX2GAAHTTTGM2
SCHEMBL14889158 0.82 LMNA (0.48) MEN1KMT2AALDH1A1TSHRABCC4
SCHEMBL8825675 0.81 ALDH1A1 (0.50) AKT1MEN1KMT2AALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113648291-B Application of benzyl ketene compound in preparing lung cancer chemotherapy sensitization medicine and medicine 丽水市中心医院 2023-03-14 CN claimed
CN-110054554-B Method for synthesizing 4-phenyl-3-butenone 辽宁石油化工大学 2022-12-30 CN claimed
CN-113648291-A Application of benzyl ketene compound in preparing lung cancer chemotherapy sensitization medicine and medicine 丽水市中心医院 2021-11-16 CN claimed
CN-113476522-A Essential oil for preventing and treating rheumatic pain 深圳禧万福实业有限公司 2021-10-08 CN claimed
CN-112695549-A Low-temperature soaping agent for printing of reactive dye and preparation method thereof 浙江震东新材料有限公司 2021-04-23 CN claimed
CN-110054554-A A method of synthesis 4- phenyl -3- butenone 辽宁石油化工大学 2019-07-26 CN claimed
CN-106905264-B A method of synthesis A Zhalawei intermediate 连云港杰瑞药业有限公司 2019-06-07 CN claimed
EP-0662490-B1 One part curable compositions containing deactivated hydrosilation catalyst and method for preparing same DOW CORNING (US) 1999-06-02 EP claimed
EP-0662490-A2 One part curable compositions containing deactivated hydrosilation catalyst and method for preparing same DOW CORNING CORPORATION (US) 1995-07-12 EP claimed
US-5380812-A Storage stability DOW CORNING CORPORATION (US) 1995-01-10 US claimed
WO-1991018861-A1 2-(HYDROXYMETHYL) ACRYLATE DERIVATIVES AND PROCESS FOR THEIR PREPARATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1991-12-12 WO claimed
US-3997708-A ADDITION PHILLIPS PETROLEUM COMPANY (US) 1976-12-14 US claimed
EP-4678025-A1 AN AEROSOL GENERATING MATERIAL Nicoventures Trading Limited (GB) 2026-01-14 EP disclosed
EP-4678015-A1 AN AEROSOL GENERATING MATERIAL Nicoventures Trading Limited (GB) 2026-01-14 EP disclosed
EP-4678024-A1 AN AEROSOL GENERATING MATERIAL Nicoventures Trading Limited (GB) 2026-01-14 EP disclosed
EP-4678021-A1 AN AEROSOL GENERATING MATERIAL Nicoventures Trading Limited (GB) 2026-01-14 EP disclosed
US-4021574-A Antidandruff compositions containing 9-(4-lower alkoxy-2,3,6-trilower-alkylphenyl)-3,7-dimethyl-nona-2,4,6,8-tetraen-1-oic acid lower alkyl amides HOFFMANN-LA ROCHE INC. (US) 1977-05-03 US disclosed
US-3997708-A ADDITION PHILLIPS PETROLEUM COMPANY (US) 1976-12-14 US disclosed
US-3936473-A COPPER OR NOBLE METAL SALT, OXYGEN AND ORGANIC ACID CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-02-03 US disclosed
US-3932573-A Process for producing glass fiber reinforced injection molding compounds ETHYL CORPORATION (US) 1976-01-13 US disclosed