SCHEMBL6602564

SCHEMBL6602564

CCCCC(=O)CC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.58
CES2 O00748 3/20 0.58
HPGD P15428 3/20 0.57
MAPT P10636 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
CYP3A4 P08684 2/20 0.57
KDM4E B2RXH2 1/20 0.57
ALOX15 P16050 1/20 0.57
MAPK1 P28482 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.52
LMNA P02545 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 3/20 0.51
PTPN1 P18031 1/20 0.50
ERCC5 P28715 1/20 0.50
FEN1 P39748 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
SCHEMBL4828357 0.95 CES1 (0.59) CES1CES2HPGDMAPTTDP1
SCHEMBL670872 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL98359 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL5274625 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL98957 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL599772 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL6552354 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL7760638 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL875304 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1
SCHEMBL599568 0.93 CES1 (0.60) CES1CES2HPGDMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104136544-A PHOTOACTIVATED, PRECIOUS METAL CATALYSTS IN CONDENSATION-CURE SILICONE SYSTEMS 3M INNOVATIVE PROPERTIES CO 2014-11-05 CN claimed
EP-0912467-B1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE SA (FR) 2002-04-24 EP claimed
EP-0912467-A1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE (FR) 1999-05-06 EP claimed
WO-1998000375-A1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE (FR) 1998-01-08 WO claimed
US-5451593-A Method of using 5-arylheteroarylalkyl-1,3,5-trisubstituted-1,2,4-triazole compounds for treatment of a glaucoma disorder G. D. SEARLE & CO. (US) 1995-09-19 US claimed
CN-109776293-B Method for preparing 1, 3-diketone compound from alkynone 温州大学 2022-04-05 CN disclosed
CN-111393269-A Method for synthesizing 1, 3-dicarbonyl compound based on one-pot method of terminal alkyne and acyl halide 温州大学 2020-07-10 CN disclosed
WO-2019232967-A1 ENVIRONMENTALLY-FRIENDLY EPDM ADHESIVE FOR IMPROVING ADHESION BETWEEN ETHYLENE-PROPYLENE-DIENE RUBBER AND CORD 南京利德东方橡塑科技有限公司 (CN) 2019-12-12 WO disclosed
CN-110204785-A A kind of floor film stabilizer and preparation method thereof 东莞市尚诺新材料有限公司 2019-09-06 CN disclosed
CN-109776293-A A method of 1,3- cyclohexadione compounds are prepared with acetylenic ketone 温州大学 2019-05-21 CN disclosed
CN-107955295-A A kind of auxiliary heat stabilizer and its preparation method and application 广东工业大学 2018-04-24 CN disclosed
CN-104136544-A PHOTOACTIVATED, PRECIOUS METAL CATALYSTS IN CONDENSATION-CURE SILICONE SYSTEMS 3M INNOVATIVE PROPERTIES CO 2014-11-05 CN disclosed
EP-0297752-B1 PROCESS OF PREPARING OPTICALLY ACTIVE ALCOHOL Takasago International Corporation (JP) 1992-09-16 EP disclosed
EP-0465405-A2 Substituted pyrroles used as stabilisers for chlorine containing polymers CIBA-GEIGY AG (CH) 1992-01-08 EP disclosed
CN-1055529-A TREATMENT OF WASTE WATER OF CIS-ANHYDRIDE BY ANAEROBIC BIOLOGICAL PROCESS NO 2 PETROCHEMICAL PLANT TIANJ (CN) 1991-10-23 CN disclosed
US-4916252-A OPTICALLY ACTIVE PHOSPHINE-RUTHENIUM HYDROGENATION CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 1990-04-10 US disclosed
EP-0162572-A1 Siloxane polyphotoinitiators of the substituted acetophenone type LOCTITE CORPORATION (US) 1985-11-27 EP disclosed
US-4534838-A Siloxane polyphotoinitiators of the substituted acetophenone type LOCTITE CORPORATION (US) 1985-08-13 US disclosed
US-4051229-A REDUCTION OF ALKALI OR ALKALINE EARTH CHLORATE IN SULFURIC OR HYDROCHLORIC ACID WITH COMPLEX B-DIKETONE-PALLADIUM CATALYST THE JAPAN CARLIT CO., LTD. (JA) 1977-09-27 US disclosed
US-4036605-A CATALYZING OXIDATION OF HYDROCARBONS WITH A B-KETOENOLATE GULF RESEARCH & DEVELOPMENT COMPANY (US) 1977-07-19 US disclosed