SCHEMBL714806

SCHEMBL714806

CC1=Cc2c(cccc2-c2cccc3ccccc23)[CH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
CYP2A6 P11509 2/20 0.39
DHFR P00374 1/20 0.37
PTPN1 P18031 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
KDM4E B2RXH2 4/20 0.36
ENPP3 O14638 1/20 0.36
ENPP1 P22413 1/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 2/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
FLT3 P36888 1/20 0.33
CYP11B2 P19099 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
ALOX15 P16050 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
SCHEMBL7268119 0.92 HPRT1 (0.44) ALDH1A1CYP2A6POLBHPGDCYP1A2
SCHEMBL6046805 0.85 ALDH1A1 (0.42) ALDH1A1CYP2A6MAOAMAOBHPGD
SCHEMBL7269626 0.85 ALDH1A1 (0.33) ALDH1A1CYP2A6KDM4EHPGDCYP1A2
SCHEMBL6652271 0.80 HTR7 (0.35) ALDH1A1CYP2A6HPGDCYP1A2TSHR
SCHEMBL6758599 0.79 PPARG (0.36) ALDH1A1CYP2A6DHFRPTPN1KDM4E
SCHEMBL8615597 0.79 ALOX15 (0.37) ALDH1A1DHFRPTPN1MAOAMAOB
SCHEMBL4473228 0.79 PTPN1 (0.37) ALDH1A1CYP2A6DHFRPTPN1MAOA
SCHEMBL7009743 0.79
SCHEMBL714429 0.78 CYP2A6 (0.42) ALDH1A1CYP2A6HPGDCYP1A2TSHR
SCHEMBL8617502 0.77 ALDH1A1 (0.40) ALDH1A1PTPN1KDM4EPOLBHPGD

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 438 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
CN-1192033-C Bridged metal complexes DOW CHEMICAL CO (US) 2005-03-09 CN claimed
EP-0779295-B1 Metallocenes BASELL POLYOLEFINE GMBH (DE) 2004-10-20 EP claimed
CN-1154668-C Dicyclopentradiene diene compound 2004-06-23 CN 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
EP-1104430-B1 ANSA GROUP-4-METAL BIS (.MU.-SUBSTITUTED) ALUMINUM METALLOCENES DOW GLOBAL TECHNOLOGIES INC (US) 2002-12-18 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
CN-1263894-A Dicyclopentradiene diene compound DOW CHEMICAL CO (US) 2000-08-23 CN claimed
WO-2000009524-A1 ANSA GROUP-4- METAL BIS (.MU.-SUBSTITUTED) ALUMINUM METALLOCENES THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
US-5945553-A Process for preparing a methylene-bridged biscyclopentadienyl compound TARGOR GMBH (DE) 1999-08-31 US claimed
WO-1999031147-A1 MIXED CATALYST SYSTEM UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-06-24 WO 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
CN-1156997-A Dicyclopentadienyl diene complexes DOW CHEMICAL CO (US) 1997-08-13 CN claimed