SCHEMBL454625

SCHEMBL454625

Fc1c(F)c(F)c([B-](c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GAA P10253 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
Potassium Ion SCHEMBL28923901 0.97 ALDH1A1 (0.32) ALDH1A1
Benzene SCHEMBL30760627 0.95 ALDH1A1 (0.33) ALDH1A1GAA
SCHEMBL677647 0.95 ALDH1A1 (0.33) ALDH1A1GAA
SCHEMBL1451098 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7173236 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1451496 0.92 ALDH1A1 (0.32) ALDH1A1
Lithium Ion SCHEMBL1452499 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL29828600 0.88 GAA (0.31) GAA
Benzenethiol SCHEMBL29634873 0.86 GAA (0.31) GAA
SCHEMBL7460569 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3954549-B1 POLYISOPRENE, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORP (JP) 2023-12-13 EP disclosed
EP-3456746-B1 TERMINAL-MODIFIED CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, AND RUBBER ARTICLE BRIDGESTONE CORP (JP) 2023-04-19 EP disclosed
US-20220220238-A1 METHOD FOR MANUFACTURING COPOLYMER BRIDGESTONE CORPORATION (JP) 2022-07-14 US disclosed
US-20220213240-A1 MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, RESIN COMPOSITION, TIRE, AND RESIN PRODUCT BRIDGESTONE CORPORATION (JP) 2022-07-07 US disclosed
US-20220185921-A1 POLYISOPRENE, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORPORATION (JP) 2022-06-16 US disclosed
EP-3988583-A1 METHOD FOR PRODUCING COPOLYMER Bridgestone Corporation (JP) 2022-04-27 EP disclosed
EP-3954549-A1 POLYISOPRENE, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORPORATION (JP) 2022-02-16 EP disclosed
EP-3954718-A1 POLYISOPRENE PRODUCTION METHOD BRIDGESTONE CORPORATION (JP) 2022-02-16 EP disclosed
US-11236185-B2 Copolymer, production method for copolymer, rubber composition, and tire BRIDGESTONE CORPORATION (JP) 2022-02-01 US disclosed
US-11214639-B2 Copolymer, rubber composition, resin composition, tire and resin product BRIDGESTONE CORPORATION (JP) 2022-01-04 US disclosed
US-20090030167-A1 POLYMERIZATION CATALYST COMPOSITION FOR POLYMERIZATION OF ISOPRENE COMPOUND RIKEN (JP) 2009-01-29 US disclosed
EP-1995257-A1 POLYMERIZATION CATALYST COMPOSITION FOR POLYMERIZATION OF ISOPRENE COMPOUND Riken (JP) 2008-11-26 EP disclosed
US-20080114136-A1 Metal Complex Containing Tridentate Ligand, and Polymerization Catalyst Comprising the Same RIKEN (JP) 2008-05-15 US disclosed
EP-1840130-A1 METAL COMPLEX CONTAINING TRIDENTATE LIGAND, AND POLYMERIZATION CATALYST COMPRISING THE SAME Riken (JP) 2007-10-03 EP disclosed
EP-0919574-B1 Polymerization catalyst, process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared UBE INDUSTRIES (JP) 2004-02-11 EP disclosed
US-6300450-B1 Conjugated diene compound polymerization catalyst process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared UBE INDUSTRIES, LTD. (JP) 2001-10-09 US disclosed
EP-0778291-B1 Catalyst and process for producing conjugated diene polymer UBE INDUSTRIES (JP) 2001-03-28 EP disclosed
US-6071845-A OBTAINED BY CONTACTING A COMPOUND OF A TRANSITION METAL OF THE GROUP V OF THE PERIODIC TABLE WITH AN IONIC COMPOUND COMPRISING A NON-COORDINATING ANION AND A CATION AND AN ALUMINOXANE UBE INDUSTRIES, LTD. (JP) 2000-06-06 US disclosed
EP-0919574-A1 Polymerization catalyst, process for the preparation of conjugated diene polymer in the presence thereof and polybutadiene thus prepared Ube Industries, Ltd. (JP) 1999-06-02 EP disclosed
EP-0778291-A1 Catalyst and process for producing conjugated diene polymer UBE INDUSTRIES, LTD. (JP) 1997-06-11 EP 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-20080114136-A1 Metal Complex Containing Tridentate Ligand, and Polymerization Catalyst Comprising the Same AP1M1, TCP1, AP3M1 ALDH1A1 941/4885GAA 3282/4885

“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.