SCHEMBL2938245

SCHEMBL2938245

Fc1cc(F)c(F)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
IDO1 P14902 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ERN1 O75460 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
SCHEMBL31150658 1.00 CES2 (0.42) CES2CES1IDO1ALDH1A1CA12
Methyl Alcohol SCHEMBL28266439 0.92 CES2 (0.43) CES2CES1IDO1CA12CA1
SCHEMBL7549121 0.84 CA12 (0.35) CES2CES1IDO1ALDH1A1CA12
SCHEMBL531337 0.77 CES2 (0.52) CES2CES1ALDH1A1CA12CA1
SCHEMBL9421248 0.77 ALDH1A1 (0.45) CES2CES1IDO1ALDH1A1
Chloromethane SCHEMBL27844640 0.75 CES2 (0.46) CES2CES1ALDH1A1CA12CA1
SCHEMBL1042005 0.73 KDM1A (0.32) CES2CES1ALDH1A1TDP1
SCHEMBL9712527 0.72 ERN1 (0.42) CES2CES1ALDH1A1CA1CA9
SCHEMBL29824002 0.72 ERN1 (0.42) CES2CES1ALDH1A1CA1CA9
SCHEMBL12121733 0.72 RAPGEF4 (0.35) CES2CES1

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 14 patents. 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
EP-0667328-B1 Process for the preparation of aromatic fluoro compounds CLARIANT GMBH (DE) 1998-09-16 EP claimed
US-5498807-A Process for the preparation of aromatic fluoro compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 US claimed
EP-0667328-A1 Process for the preparation of aromatic fluoro compounds HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-16 EP claimed
EP-1362860-B1 Method for producing tetrakis (fluoraryl)borate magnesium compound NIPPON CATALYTIC CHEM IND (JP) 2010-09-15 EP disclosed
US-7205441-B2 Method for producing tetrakis (fluoroaryl) borate-magnesium compound NIPPON SHOKUBAI CO., LTD. (JP) 2007-04-17 US disclosed
US-20030216598-A1 Method for producing tetrakis ( fluoroaryl) borate-magnesium compound NIPPON SHOKUBAI CO., LTD. (JP) 2003-11-20 US disclosed
EP-1362860-A1 Method for producing tetrakis (fluoroaryl) borate magnesium compound Nippon Shokubai Co., Ltd. (JP) 2003-11-19 EP disclosed
EP-0667328-B1 Process for the preparation of aromatic fluoro compounds CLARIANT GMBH (DE) 1998-09-16 EP disclosed
US-5498807-A Process for the preparation of aromatic fluoro compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 US disclosed
EP-0667328-A1 Process for the preparation of aromatic fluoro compounds HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-16 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-20030216598-A1 Method for producing tetrakis ( fluoroaryl) borate-magnesium compound KRAS, MGAM, CA3 CES2 3957/4885CES1 4605/4885IDO1 4265/4885

“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.