SCHEMBL3682899

SCHEMBL3682899

CC(C)(C)c1ccc2c(c1C(C)(C)C)[CH]c1ccccc1-2

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPC1 O15118 1/20 0.30
PLA2G1B P04054 1/20 0.30
NFKB1 P19838 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30

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
SCHEMBL726454 0.79 CA2 (0.40) ALDH1A1TSHRTDP1
SCHEMBL28627162 0.75 ALDH1A1 (0.31) ALDH1A1TSHRTDP1
SCHEMBL2963747 0.75 HSD11B1 (0.36) ALDH1A1
SCHEMBL1028544 0.74 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL5597066 0.72 CA2 (0.31) ALDH1A1TSHRTDP1
SCHEMBL9121969 0.71 ALDH1A1 (0.31) ALDH1A1TSHRTDP1
SCHEMBL28630479 0.70 ALDH1A1 (0.40) ALDH1A1TSHRTDP1NPC1PLA2G1B
SCHEMBL28625579 0.69 ALDH1A1 (0.35) ALDH1A1TSHRTDP1NPC1PLA2G1B
SCHEMBL9121968 0.68
SCHEMBL11020611 0.67 ALDH1A1 (0.50) ALDH1A1TSHRTDP1NPC1PLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732918-B1 NOVEL PYRROLIDINE-3,4-DICARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-11-12 EP claimed
US-20040087746-A1 Polyolefin production RAZAVI ABBAS (BE) 2004-05-06 US claimed
US-6630550-B1 Olefin monomers polymerised using these catalysts to form syndiotactic/atactic block polymers of high molecular weight and comprising at least 70% of syndiotactic triads. FINA RESEARCH, S.A. (BE) 2003-10-07 US 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
EP-1224228-A1 POLYOLEFIN PRODUCTION ATOFINA Research (BE) 2002-07-24 EP claimed
WO-2001019877-A1 POLYOLEFIN PRODUCTION ATOFINA RESEARCH (BE) 2001-03-22 WO claimed
EP-0910591-B1 SYNDIOTACTIC/ATACTIC BLOCK POLYOLEFINS, CATALYSTS AND PROCESSES FOR PRODUCING THE SAME FINA RESEARCH (BE) 2001-03-21 EP claimed
EP-1083188-A1 Catalyst and process for the preparation of syndiotactic / atactic block polyolefins FINA RESEARCH S.A. (BE) 2001-03-14 EP claimed
EP-0818475-A1 Syndiotactic/atactic block polyolefins, catalysts and processes for producing the same FINA RESEARCH S.A. (BE) 1998-01-14 EP claimed
CN-113302213-B Catalyst for olefin polymerization and process for producing olefin polymer containing polar group 国立大学法人东京大学 2023-04-14 CN disclosed
CN-113302213-A Catalyst for olefin polymerization and process for producing olefin polymer containing polar group 国立大学法人东京大学 2021-08-24 CN 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-2484685-B1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-11-01 EP disclosed
EP-0970976-A1 Copolymer, process for production thereof, and molded article thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed
EP-0970963-A2 Transition metal compound, olefin polymerization catalyst component, olefin polymerization catalyst and process for producing olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 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
EP-0749988-A2 Process for the preparation of cycloolefin copolymers HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-27 EP disclosed
EP-0749985-A2 Stereo rigid metallocene compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-27 EP disclosed