SCHEMBL320251

SCHEMBL320251

C1=CCC([C]2C=Cc3ccccc32)=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 3/20 0.35
CYP2D6 P10635 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
SETD7 Q8WTS6 2/20 0.35
TP53 P04637 2/20 0.35
CHRM2 P08172 2/20 0.35
HTR1A P08908 2/20 0.35
CHRM1 P11229 2/20 0.35
DRD2 P14416 2/20 0.35
TSHR P16473 2/20 0.35
ADRA2C P18825 2/20 0.35
CHRM3 P20309 2/20 0.35
SLC6A2 P23975 2/20 0.35
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
SLC6A4 P31645 2/20 0.35
ADRA1A P35348 2/20 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
SCHEMBL30626777 0.75
SCHEMBL28006187 0.75
SCHEMBL2836933 0.72 TSHR (0.38) CA1CA2ALDH1A1TSHRHTR7
SCHEMBL5921807 0.72 LMNA (0.50) CYP1A2CYP2D6ALDH1A1HSD17B10SETD7
SCHEMBL312236 0.71
SCHEMBL15609786 0.71 SETD7 (0.33) CYP1A2CYP2D6ALDH1A1HSD17B10SETD7
SCHEMBL965520 0.71 NPC1 (0.36) CA1CA2CYP1A2CYP2D6ALDH1A1
SCHEMBL21044936 0.70
SCHEMBL6942943 0.68
SCHEMBL15610000 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871675-B1 TACKIFIERS AND A PROCESS TO OBTAIN TACKIFIERS EXXONMOBIL CHEM PATENTS INC (US) 2002-10-30 EP claimed
CN-116023539-A Supported metallocene catalyst suitable for solution polymerization and preparation method and application thereof 中国石油化工股份有限公司 2023-04-28 CN disclosed
CN-108137729-B Catalysts for forming multimodal polymers 埃克森美孚化学专利公司 2021-02-05 CN disclosed
US-20200062874-A1 METALLOCENE COMPLEX WITH A HETEROATOM-CONTAINING PI-LIGAND AND PREPARATION METHOD THEREFOR, CATALYST SYSTEM CONTAINING THE SAME AND USE THEREOF PETROCHINA COMPANY LIMITED (CN) 2020-02-27 US disclosed
EP-3131933-B1 BORON-BRIDGED METALLOCENE CATALYST SYSTEMS AND POLYMERS PRODUCED THEREFROM CHEVRON PHILLIPS CHEMICAL CO LP (US) 2019-11-13 EP disclosed
US-10351647-B2 Polymerization process using bridged metallocene compounds supported on organoaluminum treated layered silicate supports EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-07-16 US disclosed
CN-109824802-A Metallocenic compound, catalyst system and the polymerization using them of bridging 埃克森美孚化学专利公司 2019-05-31 CN disclosed
EP-3145967-B1 DUAL CATALYST SYSTEMS FOR PRODUCING POLYMERS WITH A BROAD MOLECULAR WEIGHT DISTRIBUTION AND A UNIFORM SHORT CHAIN BRANCH DISTRIBUTION CHEVRON PHILLIPS CHEMICAL CO LP (US) 2019-04-10 EP disclosed
EP-2935297-B1 BRIDGED METALLOCENE COMPOUNDS, CATALYST SYSTEMS AND PROCESSES FOR POLYMERIZATION THEREWITH EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-03-20 EP disclosed
US-20180298127-A1 Polymerization Process Using Bridged Metallocene Compounds Supported on Organoaluminum Treated Layered Silicate Supports EXXONMOBIL CHEMICAL PATENTS INC. 2018-10-18 US disclosed
EP-1629018-A1 CLASS OF METALLOCENES AND METHOD OF PRODUCING POLYETHYLENE Univation Technologies LLC (US) 2006-03-01 EP disclosed
CN-1646619-A Improved processing of bimodal polymers ATOFINA RES SA (BE) 2005-07-27 CN disclosed
US-6911508-B2 Class of metallocenes and method of producing polyethylene UNIVATION TECHNOLOGIES, LLC (US) 2005-06-28 US disclosed
WO-2004108771-A1 CLASS OF METALLOCENES AND METHOD OF PRODUCING POLYETHYLENE UNIVATION TECHNOLOGIES, LLC (US) 2004-12-16 WO disclosed
US-20040249096-A1 Class of metallocenes and method of producing polyethylene EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-09 US disclosed
EP-1214146-B1 HYDROCARBYL PHOSPHINIMINE/CYCLOPENTADIENYL COMPLEXES OF GROUP 4 METALS AND THEIR USE IN OLEFIN POLYMERIZATION NOVA CHEM INT SA (CH) 2003-10-15 EP disclosed
US-6440890-B1 OLEFIN POLYMERIZATION CATALYSTS WHICH ARE SURPRISINGLY MORE ACTIVE THAN THEIR SIMPLE METALLOCENE ANALOGS NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2002-08-27 US disclosed
EP-1214146-A1 HYDROCARBYL PHOSPHINIMINE/CYCLOPENTADIENYL COMPLEXES OF GROUP 4 METALS AND THEIR USE IN OLEFIN POLYMERIZATION Nova Chemicals (International) S.A. (CH) 2002-06-19 EP disclosed
WO-2001019512-A1 HYDROCARBYL PHOSPHINIMINE/CYCLOPENTADIENYL COMPLEXES OF GROUP 4 AND THEIR USE IN OLEFIN POLYMERIZATION NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2001-03-22 WO disclosed
US-5391789-A Bridged, chiral metallocenes, processes for their preparation and their use as catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200062874-A1 METALLOCENE COMPLEX WITH A HETEROATOM-CONTAINING PI-LIGAND AND PREPARATION METHOD THEREFOR, CATALYST SYSTEM CONTAINING THE SAME AND USE THEREOF ORC3, ORMDL3, OR51E2 CA1 769/4885CA2 577/4885CYP1A2 1052/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.