SCHEMBL4019633

SCHEMBL4019633

O=C(NC1CCCCCC1c1ncc(C(F)(F)F)cc1Cl)c1ccccc1I

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 18/20 0.54
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL4020552 0.88 HCRTR1 (0.56) HCRTR1KDM4EPOLBGAA
SCHEMBL4024302 0.88 HCRTR1 (0.56) HCRTR1KDM4EPOLBGAA
SCHEMBL4020548 0.88 HCRTR1 (0.56) HCRTR1KDM4EPOLBGAA
SCHEMBL4025408 0.86 HCRTR1 (0.55) HCRTR1KDM4EPOLBGAA
SCHEMBL2882368 0.85 HCRTR1 (0.55) HCRTR1
SCHEMBL2882365 0.85 HCRTR1 (0.55) HCRTR1
SCHEMBL2885994 0.85 HCRTR1 (0.55) HCRTR1
SCHEMBL2889710 0.80 HCRTR1 (0.49) HCRTR1POLBGAA
SCHEMBL1660057 0.79 HCRTR1 (0.54) HCRTR1GAA
SCHEMBL16512779 0.76 HCRTR1 (0.57) HCRTR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524968-B2 2-pyridinylcycloalkylbenzamide derivatives and their use as fungicides BAYER CROPSCIENCE S.A. (FR) 2009-04-28 US disclosed
US-20070203204-A1 2-Pyridinylcycloalkylbenzamide Derivatives And Their Use As Fungicides BAYER CROPSCIENCE S.A. (FR) 2007-08-30 US disclosed
EP-1740542-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-01-10 EP disclosed
WO-2005103004-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-11-03 WO disclosed
EP-1591442-A1 2-Pyridinycycloalkylbenzamide derivatives and their use as fungicides Bayer CropScience S.A. (FR) 2005-11-02 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-20070203204-A1 2-Pyridinylcycloalkylbenzamide Derivatives And Their Use As Fungicides CYP1A2, CYP4B1, CYP1B1 HCRTR1 4059/4885KDM4E 1662/4885POLB 1860/4885

“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.