SCHEMBL3209827

SCHEMBL3209827

Bc1cc(F)c(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA4 P22748 2/20 0.32
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31

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
SCHEMBL2623418 0.84 CES2 (0.32) CES2CES1
P-Xylene SCHEMBL27966927 0.84 ACHE (0.43) CES2CES1CA1CA2CA7
Tromethamine SCHEMBL7652452 0.76 MEN1 (0.42) CES2CES1
SCHEMBL21949881 0.74 ERN1 (0.38) CES2CES1
SCHEMBL24688259 0.73 GRIN2D (0.31)
SCHEMBL13725558 0.73 HDAC1 (0.44)
SCHEMBL10067571 0.73 ESR1 (0.37) CA1CA12
SCHEMBL8091735 0.73 HDAC1 (0.44) CA1CA2
SCHEMBL5350687 0.71 CA1 (0.38) CES2CES1CA1CA2CA4
SCHEMBL1525706 0.69 CES2 (0.45) CES2CES1CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110981699-A Improvement of synthesis process of 3,4, 5-trifluorophenol 蚌埠中实化学技术有限公司 2020-04-10 CN claimed
CN-105899552-B Catalyst system 阿朗新科荷兰有限公司 2017-09-15 CN claimed
CN-106366226-A Transition metal catalyst composition and applications thereof 中国石油化工股份有限公司 2017-02-01 CN claimed
CN-105209473-A Metal complexes with Lewis base ligands LANXESS ELASTOMERS BV 2015-12-30 CN claimed
CN-103012623-B Metalloscene catalyst, its synthesis and purposes in olefin polymerization NOVOLEN TECH HOLDINGS CV (DE) 2015-09-16 CN claimed
CN-103086842-B Synthetic method of 3,3 ', 4,4 ', 5,5 ' -hexafluorobiphenyl LIANHE CHEMICAL TECHNOLOGY CO LTD 2015-04-29 CN claimed
CN-104159929-A Supported composite metallocene catalyst, method for preparing the same, and method for preparing polyolefin using the same SK INNOVATION CO LTD 2014-11-19 CN claimed
CN-103509060-A Metallocene compound, catalyst composite containing metallocene compound and olefin polymerization method using metallocene compound DAELIM IND CO LTD 2014-01-15 CN claimed
CN-103012623-A Metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV 2013-04-03 CN claimed
CN-101253207-A Process for producing thermoplastic elastomer material PIRELLI & C SPA (IT) 2008-08-27 CN claimed
US-20260103484-A1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING THE SAME, AND METHOD FOR PREPARING OLEFIN POLYMER USING THE SAME SABIC SK NEXLENE COMPANY PTE LTD (SG) 2026-04-16 US disclosed
WO-2024069256-A1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING THE SAME, AND METHOD FOR PREPARING OLEFIN POLYMER USING THE SAME SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2024-04-04 WO disclosed
CN-110981699-B Improved synthesis process of 3,4, 5-trifluoro phenol 蚌埠中实化学技术有限公司 2023-09-29 CN disclosed
CN-111094390-B Method for producing polyols 陶氏环球技术有限责任公司 2023-06-20 CN disclosed
CN-111225938-B Method for producing surfactants and lubricants 陶氏环球技术有限责任公司 2023-06-16 CN disclosed
EP-1523508-A1 \"CONSTRAINED GEOMETRY\" METALLOCENES, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME FOR THE POLYMERISATION OF OLEFINS Celanese Ventures GmbH (DE) 2005-04-20 EP disclosed
WO-2003080684-A1 'CONSTRAINED GEOMETRY' METALLOCENES, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME FOR THE POLYMERISATION OF OLEFINS CELANESE VENTURES GMBH (DE) 2003-10-02 WO disclosed
CN-1330085-A Transition metal compound, catalyst for polyaddition and method for preparing addition polymer SUMITOMO CHEMICAL CO (JP) 2002-01-09 CN disclosed
EP-0942938-A1 SUPPORTED CATALYST SYSTEM, METHOD FOR THE PRODUCTION AND USE THEREOF IN OLEFIN POLYMERIZATION Basell Polyolefine GmbH (DE) 1999-09-22 EP disclosed
WO-1998040416-A1 SUPPORTED CATALYST SYSTEM, METHOD FOR THE PRODUCTION AND USE THEREOF IN OLEFIN POLYMERIZATION TARGOR GMBH (DE) 1998-09-17 WO 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-20260103484-A1 TRANSITION METAL COMPOUND, CATALYST COMPOSITION COMPRISING THE SAME, AND METHOD FOR PREPARING OLEFIN POLYMER USING THE SAME MMP20, CYC1, SOD1 CES2 1009/4885CES1 829/4885CA1 141/4885

“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.