SCHEMBL1660057

SCHEMBL1660057

O=C(NC1CCCCC1c1ncc(Cl)cc1Cl)c1ccccc1C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 8/20 0.54
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
PTGES O14684 9/20 0.45
CNR2 P34972 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL17863662 0.95 HCRTR1 (0.50) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL16512784 0.95 HCRTR1 (0.50) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL16486932 0.95 HCRTR1 (0.50) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL4020552 0.91 HCRTR1 (0.56) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL4024302 0.91 HCRTR1 (0.56) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL4020548 0.91 HCRTR1 (0.56) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL16486704 0.80 HCRTR1 (0.49) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL16512738 0.80 HCRTR1 (0.49) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL16486620 0.80 HCRTR1 (0.49) HCRTR1TAS1R3TAS1R1TAS1R2PTGES
SCHEMBL20747142 0.80 HCRTR1 (0.49) HCRTR1TAS1R3TAS1R1TAS1R2PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932396-B2 2-pyridinylcycloalkylbenzamide derivatives and their use as fungicides BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
US-20090076096-A1 2-Pyridinylcycloalkylbenzamide derivatives and their use as fungicides BAYER CROPSCIENCE AG (DE) 2009-03-19 US disclosed
EP-1885698-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2008-02-13 EP disclosed
WO-2006122952-A1 2-PYRIDINYLCYCLOALKYLBENZAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-11-23 WO 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-20090076096-A1 2-Pyridinylcycloalkylbenzamide derivatives and their use as fungicides CYP1A2, CYP4B1, CYP4F2 HCRTR1 3971/4885TAS1R3 1877/4885TAS1R1 2023/4885

“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.