SCHEMBL2187610

SCHEMBL2187610

OCn1cnc(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.34
HDAC6 Q9UBN7 2/20 0.31
KDM2B Q8NHM5 1/20 0.31
PHF8 Q9UPP1 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
Hydrochloric Acid SCHEMBL27924393 0.82 LOXL2 (0.38) EGLN2HDAC6KDM2BPHF8
SCHEMBL31252010 0.79 NOS1 (0.36) HDAC6KDM2BPHF8
SCHEMBL13792540 0.79 EGLN2 (0.32) EGLN2HDAC6KDM2BPHF8
SCHEMBL30320413 0.78 TRPV4 (0.32) HDAC6KDM2BPHF8
SCHEMBL15485019 0.77 ALDH1A1 (0.39)
SCHEMBL17653982 0.76 LMNA (0.37) EGLN2
SCHEMBL5425819 0.72 TBXAS1 (0.40)
SCHEMBL11238237 0.71 CSF1R (0.31)
SCHEMBL11240014 0.71 KDM2B (0.31) KDM2BPHF8
SCHEMBL11238229 0.71 CSF1R (0.31)

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108714224-B PH response type19F magnetic resonance imaging nano probe and preparation method thereof 北京化工大学 2020-06-16 CN disclosed
US-8309589-B2 Fluorine-containing organosulfur compound and pesticidal composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-13 US disclosed
EP-1710234-B1 MALONONITRILE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2011-07-13 EP disclosed
US-20100240722-A1 FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION COMPRISING THE SAME Sumitomoo Chemical Company, Limited (JP) 2010-09-23 US disclosed
EP-2190821-A1 FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION COMPRISING THE SAME Sumitomo Chemical Company, Limited (JP) 2010-06-02 EP disclosed
US-7541374-B2 Malononitrile compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-02 US disclosed
US-7541374-B2 Malononitrile compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-02 US disclosed
WO-2009028727-A1 FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-05 WO disclosed
US-20070117854-A1 Malononitrile compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-24 US disclosed
US-20070117854-A1 Malononitrile compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-24 US disclosed
EP-1710234-A1 MALONONITRILE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2006-10-11 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 (2 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-20100240722-A1 FLUORINE-CONTAINING ORGANOSULFUR COMPOUND AND PESTICIDAL COMPOSITION COMPRISING THE SAME CBR3, CYCS, DDT EGLN2 558/4885HDAC6 673/4885KDM2B 2386/4885
US-20070117854-A1 Malononitrile compounds and use thereof ME1, DDT, CYP51A1 EGLN2 830/4885HDAC6 3289/4885KDM2B 1043/4885

“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.