SCHEMBL7053653

SCHEMBL7053653

CCC1=Cc2c(cccc2C(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRB2 P47870 2/20 0.35
FAAH O00519 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
GABRB1 P18505 1/20 0.35
PTGS1 P23219 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
HTR2B P41595 1/20 0.35
GABRA2 P47869 1/20 0.35

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
SCHEMBL7777919 0.84 SOAT1 (0.38) GABRA1GABRG2GABRB3GABRB2FAAH
SCHEMBL7047520 0.78 GABRA1 (0.40) GABRA1GABRG2GABRB3GABRB2FAAH
SCHEMBL5954049 0.77 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2FAAH
SCHEMBL5953499 0.77 CYP1A2 (0.30) CYP1A2
SCHEMBL16393791 0.77 GABRA1 (0.39) GABRA1GABRB2LMNATSHRHTR2C
SCHEMBL2975173 0.75 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL5953900 0.75 ADRA2A (0.40) TAAR1
SCHEMBL7056142 0.72 HTR2A (0.40) CA1CA2
SCHEMBL1583270 0.71 DPP4 (0.39)
SCHEMBL5953689 0.69 HTR2A (0.39) CYP1A2CYP3A4HPGD

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1227271-C Solid catalytic composition for olefin polymerization ATOCHEM ELF SA (FR) 2005-11-16 CN disclosed
EP-0985674-B1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS MITSUBISHI CHEM CORP (JP) 2003-04-23 EP disclosed
EP-0889065-B1 Solid catalyst component for the polymerisation of olefins ATOFINA (FR) 2001-08-22 EP disclosed
US-6255515-B1 COORDINATION POLYMERIZATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-03 US disclosed
US-6057258-A Solid catalytic component for the polymerization of olefins ELF ATOCHEM S.A. (FR) 2000-05-02 US disclosed
EP-0985674-A1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-15 EP disclosed
EP-0889065-A1 Solid catalyst component for the polymerisation of olefins ELF ATOCHEM S.A. (FR) 1999-01-07 EP disclosed
CN-1203924-A Solid catalytic composition for olefin polymerization ATOCHEM ELF SA (FR) 1999-01-06 CN disclosed
US-5789593-A REACTING AN INDANONE WITH HYDROGEN IN THE PRESENCE OF A METAL OXIDE CATALYST TARGAR GMBH (DE) 1998-08-04 US disclosed
CN-1160702-A Process for producing indene HOECHST AG (DE) 1997-10-01 CN disclosed
EP-0794165-A1 Process for the preparation of indenes HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-10 EP disclosed