SCHEMBL125969

SCHEMBL125969

Fc1cc(F)cc(B(c2cc(F)cc(F)c2)c2cc(F)cc(F)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.32
IDO1 P14902 2/20 0.32
ORAI1 Q96D31 1/20 0.30
ORAI2 Q96SN7 1/20 0.30
ORAI3 Q9BRQ5 1/20 0.30
TRPV6 Q9H1D0 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
SCHEMBL7033847 0.86 ORAI1 (0.46) CA12CA1CA9ORAI1ORAI2
SCHEMBL8755077 0.82 ACHE (0.41) CES2CES1RAPGEF4IDO1
SCHEMBL29229465 0.76 CA12 (0.40) CA12CA1CA9CES2CES1
SCHEMBL1493119 0.76 CA12 (0.40) CA12CA1CA9CES2CES1
SCHEMBL449836 0.76
SCHEMBL124847 0.73 CA1 (0.45) CA12CA1CA9CES2CES1
SCHEMBL6246558 0.73 TRPV6 (0.52) CA12CA1CA9CES2CES1
SCHEMBL7706033 0.73 CA12 (0.38) CA12CA1CA9CES2CES1
SCHEMBL30577822 0.71 CA12 (0.57) CA12CA1CA9CES2CES1
SCHEMBL29032005 0.71 CA12 (0.57) CA12CA1CA9CES2CES1

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 1672 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930880-A Polyethylene rich in serial crystal structure and preparation method and application thereof 浙江大学 2025-05-06 CN claimed
CN-116656036-B High-toughness polyolefin film and preparation method thereof 浙江大学宁波“五位一体”校区教育发展中心 2025-04-04 CN claimed
CN-116987220-B High-strength high-toughness high-hardness polyolefin and application thereof 浙江大学 2025-04-04 CN claimed
CN-116731231-B Low-haze high-light-transmittance polyolefin copolymer and application thereof 浙江大学 2025-04-04 CN claimed
CN-115991721-B Phosphine-containing compound, preparation method thereof and application of phosphine-containing compound as ligand of ethylene oligomerization catalyst composition 中化学科学技术研究有限公司 2025-02-18 CN claimed
CN-119192715-A Wide-distribution easy-processing polyethylene and application thereof 浙江大学 2024-12-27 CN claimed
CN-119192714-A Easily-processed high-impact polyethylene and preparation method and application thereof 浙江大学 2024-12-27 CN claimed
CN-112745366-B Silicon-based bridged metallocene compound, and preparation method and application thereof 中国石油化工股份有限公司 2024-05-24 CN claimed
CN-117756842-A Shan Maomao metal catalyst, and preparation method and application thereof 国家能源集团宁夏煤业有限责任公司 2024-03-26 CN claimed
CN-117447530-A Symmetrical dinuclear metallocene catalyst, preparation method and application thereof 国家能源集团宁夏煤业有限责任公司 2024-01-26 CN claimed
WO-2005105863-A2 METALLOCENE LIGANDS, METALLOCENE COMPOUNDS AND METALLOCENE CATALYSTS, THEIR SYNTHESIS AND THEIR USE FOR THE POLYMERIZATION OF OLEFINS NOVOLEN TECHNOLOGY HOLDINGS C.V. (NL) 2005-11-10 WO claimed
US-20050239979-A1 Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins LUMMUS NOVOLEN TECHNOLOGY GMBH (DE) 2005-10-27 US claimed
US-20050136269-A1 Polysiloxanes containing (meth)acrylic ester groups attached via SiOC groups, processes for preparing them and their use as a radiation-curable abhesive coating EVONIK GOLDSCHMIDT GMBH (DE) 2005-06-23 US claimed
EP-1544232-A1 Polysiloxanes with SiOC-bounded (meth)acrylic acid ester groups, process for their preparation and their use as irradiation-curable release coating Goldschmidt GmbH (DE) 2005-06-22 EP claimed
US-20040186260-A1 Process for the reaction of polyorganosiloxanes GOLDSCHMIDT GMBH (DE) 2004-09-23 US claimed
EP-1460099-A1 Process for modifying polysiloxanes Goldschmidt AG (DE) 2004-09-22 EP claimed
EP-1358142-A1 PROCESS FOR ALKOXYLATION WITH A BORON-CONTAINING CATALYST Rhodia, Inc. (US) 2003-11-05 EP claimed
US-20020128521-A1 Process for alkoxylation with a boron-containing catalyst RHODIA OPERATIONS (FR) 2002-09-12 US claimed
WO-2002057209-A1 PROCESS FOR ALKOXYLATION WITH A BORON-CONTAINING CATALYST RHODIA, INC. (US) 2002-07-25 WO claimed
WO-2002038637-A1 METHOD FOR COPOLYMERIZING PROPENE AND/OR ETHENE WITH 1-OLEFINS ON METALLOCENE CARRIER CATALYSTS BASELL POLYPROPYLEN GMBH (DE) 2002-05-16 WO claimed

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-20020128521-A1 Process for alkoxylation with a boron-containing catalyst ALKBH3, AOX1, FOXO3 CA12 361/4885CA1 1435/4885CA9 420/4885

“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.