SCHEMBL215717

SCHEMBL215717

CCCCc1cccc2c1[CH]c1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
LIPG Q9Y5X9 1/20 0.39
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
ELANE P08246 2/20 0.35
CTSG P08311 2/20 0.35
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
TLR8 Q9NR97 1/20 0.34
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33
BCL2L1 Q07817 2/20 0.33
BAK1 Q16611 2/20 0.33
KAT8 Q9H7Z6 2/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
EP300 Q09472 1/20 0.33
KAT2A Q92830 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
SCHEMBL216507 0.95 NR1H2 (0.48) NR1H2NR1H3LIPGELANECTSG
SCHEMBL215260 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL215850 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL216548 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL216255 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL2972881 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL218348 0.93 NR1H2 (0.50) NR1H2NR1H3LIPGELANECTSG
SCHEMBL219160 0.89 NR1H2 (0.34) NR1H2NR1H3LIPGELANECTSG
SCHEMBL2973836 0.83
SCHEMBL217439 0.82 NR1H2 (0.36) NR1H2NR1H3LIPGCYP3A4CYP2D6

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 213 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
CN-101291960-A Impact copolymer of propylene prepared in single reactor TOTAL PETROCHEMICALS RES FELUY (BE) 2008-10-22 CN claimed
EP-1768990-B1 IMPROVED SYNTHESIS OF ANSA-METALLOCENES AND THEIR PARENT LIGANDS IN HIGH YIELD CHEVRON PHILLIPS CHEMICAL CO (US) 2008-10-01 EP claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US 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
US-6448349-B1 STEREORIGID METALLOCENE FOR BLOCK GAS PHASE POLYMERIZING OLEFINS HAVING THREE OR MORE CARBON ATOMS FINA RESEARCH, S.A. (BE) 2002-09-10 US claimed
CN-1260807-A Polymerization method for olefrines BOREALL AS (DK) 2000-07-19 CN claimed
WO-2021153532-A1 POLYAMIDE COMPOSITION 三井化学株式会社 2021-08-05 WO disclosed
WO-2021101153-A1 OLEFINIC POLYMER AND PREPARATION METHOD THEREFOR 한화솔루션 주식회사 2021-05-27 WO disclosed
WO-2021020778-A1 TRANSITION METAL COMPOUND FOR OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION CATALYST INCLUDING SAME, AND POLYOLEFIN POLYMERIZED USING SAME 한화솔루션 주식회사 2021-02-04 WO disclosed
WO-2020203402-A1 RESIN COMPOSITION 三井化学株式会社 2020-10-08 WO disclosed
WO-1998058001-A1 OLEFIN POLYMERIZATION PROCESS COCKBAIN, JULIAN (GB) 1998-12-23 WO disclosed
EP-0868441-A2 TRANSITION METAL COMPOUND TARGOR GmbH (DE) 1998-10-07 EP disclosed
EP-0852230-A1 TRANSITION METAL COMPLEXES, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-07-08 EP 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
WO-1997023512-A1 TRANSITION METAL COMPOUND TARGOR GMBH (DE) 1997-07-03 WO disclosed