SCHEMBL714807

SCHEMBL714807

CC1=C(c2cccc3ccccc23)c2ccccc2[CH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
CYP2A6 P11509 1/20 0.42
POLB P06746 1/20 0.41
DHFR P00374 1/20 0.39
KDM4E B2RXH2 3/20 0.39
PTPN1 P18031 1/20 0.39
ALPL P05186 1/20 0.39
GAA P10253 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
HPGD P15428 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
KEAP1 Q14145 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ENPP3 O14638 1/20 0.37
ENPP1 P22413 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37

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
SCHEMBL7268123 0.86 HSD17B10 (0.40) ALDH1A1CYP2A6POLBKDM4EHPGD
SCHEMBL7269629 0.84 CES1 (0.36) ALDH1A1CYP2A6POLBKDM4EGAA
SCHEMBL4622945 0.79 ALDH1A1 (0.38) ALDH1A1CYP2A6POLBDHFRHPGD
SCHEMBL5081775 0.79 ALDH1A1 (0.38) ALDH1A1CYP2A6POLBDHFRHPGD
SCHEMBL6651463 0.78 DHFR (0.38) ALDH1A1CYP2A6POLBDHFRKDM4E
SCHEMBL7269663 0.77 TDP1 (0.37) ALDH1A1CYP2A6POLBDHFRKDM4E
SCHEMBL8154866 0.77 MAOA (0.39) ALDH1A1CYP2A6POLBDHFRKDM4E
SCHEMBL5599459 0.75 DHFR (0.41) ALDH1A1CYP2A6POLBDHFRKDM4E
SCHEMBL7262259 0.75 TDP1 (0.36) ALDH1A1CYP2A6POLBKDM4EGAA
SCHEMBL218375 0.74 ALDH1A1 (0.42) ALDH1A1CYP2A6POLBDHFRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741417-B2 Preparation of polymerization catalyst activators utilizing indole-modified silica supports EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-22 US claimed
US-20070055028-A1 Preparation of polymerization catalyst activators utilizing indole-modified silica supports EXXONMOBIL CHEMICAL PATENTS INC. 2007-03-08 US claimed
EP-1501843-B1 ALKARYL-SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2006-06-14 EP claimed
EP-0779295-B1 Metallocenes BASELL POLYOLEFINE GMBH (DE) 2004-10-20 EP claimed
EP-0779306-B1 Process for preparation of cycloolefin copolymers TICONA GMBH (DE) 2003-12-03 EP claimed
EP-1328533-A1 BRIDGED YLIDE GROUP CONTAINING METAL COMPLEXES Dow Global Technologies Inc. (US) 2003-07-23 EP claimed
US-6476283-B1 Hydrogenation of unsaturated polymers using divalent diene-containing bis-cyclopentadienyl group IV metal catalysts THE DOW CHEMICAL COMPANY 2002-11-05 US claimed
WO-2002034759-A1 BRIDGED YLIDE GROUP CONTAINING METAL COMPLEXES DOW GLOBAL TECHNOLOGIES INC. (US) 2002-05-02 WO claimed
EP-1134227-A2 Methylene-bridged biscyclopentadienyl compounds Basell Polyolefine GmbH (DE) 2001-09-19 EP claimed
US-6255508-B1 COORDINATION CATALYST; ALPHA-OLEFIN POLYMERIZATION CATALYST TARGOR GMBH (DE) 2001-07-03 US claimed
EP-0901497-B1 YTTRIUM CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS DOW CHEMICAL CO (US) 2001-01-10 EP claimed
US-6160065-A Yttrium containing metal complexes and olefin polymerization process THE DOW CHEMICAL COMPANY (US) 2000-12-12 US claimed
US-5945553-A Process for preparing a methylene-bridged biscyclopentadienyl compound TARGOR GMBH (DE) 1999-08-31 US claimed
CN-1216548-A Yttrium-containing metal complexes and olefin polymerization process DOW CHEMICAL CO (US) 1999-05-12 CN claimed
EP-0901497-A1 YTTRIUM CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-03-17 EP claimed
US-5808122-A Organometallic compound HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-15 US claimed
US-5726333-A POLYMERIZATION CATALYSTS HOECHST AG (DE) 1998-03-10 US claimed
WO-1997043294-A1 YTTRIUM CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1997-11-20 WO claimed
EP-3587457-B1 METHOD OF TRANSFERRING SLURRY AND METHOD OF PRODUCING POLYOLEFIN SUMITOMO CHEMICAL CO (JP) 2023-09-27 EP disclosed
EP-0654476-A1 Metallocenes, their preparation and use as catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-24 EP disclosed