SCHEMBL2933659

SCHEMBL2933659

Fc1cc(F)c(Br)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA4 P22748 2/20 0.35
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
KDM1A O60341 2/20 0.34
KDM1B Q8NB78 1/20 0.34
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
AKR1B1 P15121 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
SCHEMBL31258564 1.00 CA1 (0.35) CA1CA2CA4CA12CA7
SCHEMBL29387130 0.87 KDM1A (0.37) CA1CA2CA4CA12CA7
SCHEMBL28420644 0.81 AKR1B1 (0.35) CA1CA2CA4CA12CA7
SCHEMBL439846 0.80 CA1 (0.38) CA1CA2CA4CA12CA7
SCHEMBL11884949 0.79 APEX1 (0.38) CA1CA2CA4CA12CA7
SCHEMBL21218726 0.79 AKR1B1 (0.34) KDM1AKDM1BAKR1B1
SCHEMBL6553501 0.78 CA1 (0.36) CA1CA2CA4CA12CA7
SCHEMBL28498845 0.77 CA1 (0.32) CA1CA2CA4CA12CA7
SCHEMBL7702552 0.75 CA1 (0.43) CA1CA2CA4CA12CA7
SCHEMBL41646 0.75 CA1 (0.43) CA1CA2CA4CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1362860-B1 Method for producing tetrakis (fluoraryl)borate magnesium compound NIPPON CATALYTIC CHEM IND (JP) 2010-09-15 EP claimed
US-7205441-B2 Method for producing tetrakis (fluoroaryl) borate-magnesium compound NIPPON SHOKUBAI CO., LTD. (JP) 2007-04-17 US claimed
US-20030216598-A1 Method for producing tetrakis ( fluoroaryl) borate-magnesium compound NIPPON SHOKUBAI CO., LTD. (JP) 2003-11-20 US claimed
EP-1362860-A1 Method for producing tetrakis (fluoroaryl) borate magnesium compound Nippon Shokubai Co., Ltd. (JP) 2003-11-19 EP claimed
CN-114751890-B Organic compound based on binaphthyl amine derivative and organic electroluminescent device 季华恒烨(佛山)电子材料有限公司 2023-11-17 CN disclosed
CN-114105894-B Light-emitting compound, light-emitting layer material, organic electroluminescent device, and electronic apparatus 季华实验室 2022-10-04 CN disclosed
CN-114751890-A Organic compound based on binaphthylamine derivative and organic electroluminescent device 季华恒烨(佛山)电子材料有限公司 2022-07-15 CN disclosed
CN-114105894-A Light-emitting compound, light-emitting layer material, organic electroluminescent device, and electronic apparatus 季华实验室 2022-03-01 CN disclosed
US-20220000112-A1 DIARYLIMIDAZOLE COMPOUND AND HARMFUL ORGANISM CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2022-01-06 US disclosed
EP-3766871-A1 DIARYLIMIDAZOLE COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2021-01-20 EP disclosed
EP-3181552-B1 DIARYL IMIDAZOLE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO (JP) 2020-10-21 EP disclosed
US-20200187501-A1 DIARYLIMIDAZOLE COMPOUND AND HARMFUL ORGANISM CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2020-06-18 US disclosed
US-4536344-A USING A PHOSPINE OR PHOSPHITE BAYER AKTIENGESELLSCHAFT (DE) 1985-08-20 US disclosed
EP-0109606-A1 Process for the formylation of aryl halides BAYER AG (DE) 1984-05-30 EP disclosed
EP-0024019-B1 PROCESS FOR THE PRODUCTION OF 4-FLUORO-3-PHENOXY-TOLUENE BAYER AG (DE) 1982-08-11 EP disclosed
US-4316994-A Preparation of 4-fluoro-3-phenoxy-toluene BAYER AKTIENGESELLSCHAFT (DE) 1982-02-23 US disclosed
EP-0008734-B1 PROCESS FOR THE PREPARATION OF 4-FLUOR-3-PHENOXYTOLUENE BAYER AG (DE) 1981-07-29 EP disclosed
US-4266082-A Preparation of 4-fluoro-3-phenoxy-toluene BAYER AKTIENGESELLSCHAFT (DE) 1981-05-05 US disclosed
EP-0024019-A1 Process for the production of 4-fluoro-3-phenoxy-toluene BAYER AG (DE) 1981-02-18 EP disclosed
EP-0008734-A1 Process for the preparation of 4-fluor-3-phenoxytoluene BAYER AG (DE) 1980-03-19 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 (3 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-20030216598-A1 Method for producing tetrakis ( fluoroaryl) borate-magnesium compound KRAS, MGAM, CA3 CA1 190/4885CA2 119/4885CA4 257/4885
US-20200187501-A1 DIARYLIMIDAZOLE COMPOUND AND HARMFUL ORGANISM CONTROL AGENT NOX1, L3MBTL1, MRM1 CA1 719/4885CA2 309/4885CA4 641/4885
US-20220000112-A1 DIARYLIMIDAZOLE COMPOUND AND HARMFUL ORGANISM CONTROL AGENT NOX1, L3MBTL1, MRM1 CA1 719/4885CA2 309/4885CA4 641/4885

“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.