SCHEMBL219035

SCHEMBL219035

[C]1=C(c2cccc3ccccc23)C=CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.38
KDM4E B2RXH2 3/20 0.35
GAA P10253 2/20 0.35
PTPN1 P18031 1/20 0.35
ALPL P05186 1/20 0.35
ALDH1A1 P00352 5/20 0.34
HSD17B10 Q99714 4/20 0.34
CYP2A6 P11509 3/20 0.34
TSHR P16473 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
HPGD P15428 3/20 0.34
MAPT P10636 3/20 0.34
GALR1 P47211 1/20 0.34
CYP1A2 P05177 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33

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
SCHEMBL215378 0.73 NPC1 (0.35) NISCHGAAALDH1A1TSHRHPGD
SCHEMBL2970250 0.70 BCAT1 (0.31)
SCHEMBL25302086 0.70 ALDH1A1 (0.59) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL29350007 0.70 ALDH1A1 (0.59) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL27953 0.70 ALDH1A1 (0.59) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL2972485 0.69 TRPA1 (0.31) ALDH1A1TSHR
Bromide SCHEMBL8588309 0.67 ALDH1A1 (0.56) NISCHKDM4EGAAPTPN1ALPL
Ammonia Solution, Strong SCHEMBL3156160 0.67 ALDH1A1 (0.56) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL18174178 0.67 ALDH1A1 (0.56) NISCHKDM4EGAAPTPN1ALPL
SCHEMBL17836548 0.67 ALDH1A1 (0.56) NISCHKDM4EGAAPTPN1ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140219911-A1 DIHYDROXYBIPYRIDINE COMPLEXES OF RUTHENIUM AND IRIDIUM FOR WATER OXIDATION AND HYDROGENATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2014-08-07 US claimed
WO-2013033018-A2 DIHYDROXYBIPYRIDINE COMPLEXES OF RUTHENIUM AND IRIDIUM FOR WATER OXIDATION AND HYDROGENATION DREXEL UNIVERSITY (US) 2013-03-07 WO claimed
EP-0993478-B2 OLEFIN POLYMERIZATION PROCESS BOREALIS TECH OY (FI) 2011-01-19 EP claimed
US-6921799-B1 Olefin polymerization process BOREALIS A/S (DK) 2005-07-26 US claimed
CN-1157427-C Polymerization method for olefrines �����ɷ� 2004-07-14 CN claimed
EP-0993478-B1 OLEFIN POLYMERIZATION PROCESS BOREALIS TECH OY (FI) 2004-04-07 EP claimed
CN-1260807-A Polymerization method for olefrines BOREALL AS (DK) 2000-07-19 CN claimed
EP-0993478-A1 OLEFIN POLYMERIZATION PROCESS BOREALIS A/S (DK) 2000-04-19 EP claimed
WO-1998058001-A1 OLEFIN POLYMERIZATION PROCESS COCKBAIN, JULIAN (GB) 1998-12-23 WO claimed
US-10421921-B2 Lubricants from mixed alpha-olefin feeds EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-09-24 US disclosed
EP-2752401-B1 PRODUCTION METHOD FOR 2-ALKENYLAMINE COMPOUND SHOWA DENKO KK (JP) 2018-10-10 EP disclosed
US-9919300-B2 1-hexene production process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-20 US disclosed
EP-1920031-B1 LUBRICANTS FROM MIXED ALPHA-OLEFIN FEEDS EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-01-10 EP disclosed
CN-107365397-A Multimodal polyolefin resin and shaped article prepared therefrom with high molten intensity 大林产业株式会社 2017-11-21 CN disclosed
CN-1216553-A Olefin polymer, films or sheets made therefrom, and process for the production of olefin polymer SUMITOMO CHEMICAL CO (JP) 1999-05-12 CN disclosed
EP-0908435-A1 Method for purifying transition metal compound and method for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-04-14 EP disclosed
CN-1205340-A Propylene coplymer SUMITOMO CHEMICAL CO (JP) 1999-01-20 CN disclosed
WO-1998058001-A1 OLEFIN POLYMERIZATION PROCESS COCKBAIN, JULIAN (GB) 1998-12-23 WO disclosed
CN-1193323-A Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex, and process for producing olefin polymer SUMITOMO CHEM IND (JP) 1998-09-16 CN disclosed
EP-0842939-A1 TRANSITION METAL COMPLEX, PROCESS FOR THE PREPARATION THEREOF, POLYMERIZATION CATALYST FOR OLEFINS CONTAINING THE COMPLEX, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-20 EP disclosed