SCHEMBL599099

SCHEMBL599099

CCc1cccc(CC)c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.57
GABRB2 P47870 4/20 0.57
NLRP3 Q96P20 2/20 0.41
ELANE P08246 1/20 0.39
MGLL Q99685 1/20 0.39
PDK2 Q15119 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTR1A P08908 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
PIK3CA P42336 1/20 0.36
DAO P14920 1/20 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
Ammonia Solution, Strong SCHEMBL9357829 0.97 GABRA1 (0.55) GABRA1GABRB2NLRP3ELANEMGLL
Water SCHEMBL28182555 0.97 GABRA1 (0.55) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL9839875 0.92 GABRA1 (0.50) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL28530200 0.87 GABRA1 (0.46) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL28168607 0.87 GABRA1 (0.46) GABRA1GABRB2NLRP3ELANEKCNH2
SCHEMBL14402607 0.87 GABRA1 (0.46) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL17646423 0.87 GABRA1 (0.48) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL4888235 0.87 PDCD1 (0.55) GABRA1GABRB2NLRP3PDCD1CD274
SCHEMBL21337908 0.87 GABRA1 (0.46) GABRA1GABRB2NLRP3ELANEMGLL
SCHEMBL140570 0.86 GABRA1 (0.50) GABRA1GABRB2NLRP3MAPTTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104109213-A Catalyst component for olefin polymerization and catalyst thereof BEIJING LIHE ZHIXIN TECHNOLOGY CO LTD 2014-10-22 CN claimed
CN-104109212-A Solid catalyst component used for olefin polymerization and catalyst BEIJING LIHE ZHIXIN TECHNOLOGY CO LTD 2014-10-22 CN claimed
CN-104058967-A Unsaturated cyclosubstituted diacid ester compound suitable for preparing olefin polymerization catalyst BEIJING LIHE ZHIXIN TECHNOLOGY LTD 2014-09-24 CN claimed
CN-104045748-A Solid catalyst component for olefin polymerization and catalyst BEIJING LIHE ZHIXIN TECHNOLOGY LTD 2014-09-17 CN claimed
CN-104017113-A Catalyst component for olefin polymerization, catalyst containing catalyst component and application of catalyst BEIJING LIHE ZHIXIN TECHNOLOGY CO LTD 2014-09-03 CN claimed
EP-0464277-B1 Process for the separation by adsorption of 2,6- or 3,5-diethyltoluene from a mixture thereof with another diethyltoluene isomer UOP INC (US) 1995-11-22 EP claimed
EP-0412215-B1 Adsorptive separation of para-xylene. UOP INC (US) 1994-07-13 EP claimed
EP-0464277-A1 Process for the separation by adsorption of 2,6- or 3,5-diethyltoluene from a mixture thereof with another diethyltoluene isomer UOP (US) 1992-01-08 EP claimed
US-5012038-A Preferential adsorption onto crystalline aluminum silicate, then solvent extraction UOP (US) 1991-04-30 US claimed
CN-1049329-A With diethyl toluene as strippant fractionation by adsorption p-Xylol UOP INC (US) 1991-02-20 CN claimed
EP-0412215-A1 Adsorptive separation of para-xylene. UOP (US) 1991-02-13 EP claimed
US-4973782-A FROM METHANOL AND P-DIETHYLBENZENE, AMORPHOUS ALUMINA-SILICA CATALYST UOP (US) 1990-11-27 US claimed
US-4940548-A Chromatographic separation process for recovering individual diethyltoluene isomers UOP (US) 1990-07-10 US claimed
US-3962357-A FROM SUBSTITUTED ETHYLTOLUENE, CONTINUOUS, SINGLE STEP ROHM AND HAAS COMPANY (US) 1976-06-08 US claimed
CN-108389512-B Laminate, flexible device, and method for producing laminate 东京应化工业株式会社 2022-04-15 CN disclosed
CN-108387954-B Laminate, flexible device, and method for producing laminate 东京应化工业株式会社 2022-01-18 CN disclosed
EP-2826777-B1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INST IND TECH (KR) 2020-08-05 EP disclosed
US-4279928-A Method of lowering blood pressure WILLIAM H. RORER, INC. (US) 1981-07-21 US disclosed
US-4241087-A AMIDINOUREAS WILLIAM H. RORER, INC. (US) 1980-12-23 US disclosed
US-3962357-A FROM SUBSTITUTED ETHYLTOLUENE, CONTINUOUS, SINGLE STEP ROHM AND HAAS COMPANY (US) 1976-06-08 US disclosed