SCHEMBL2089714

SCHEMBL2089714

C=CC(F)c1[nH]ncc1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 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
SCHEMBL7248717 0.81 TDP1 (0.33) TDP1TSHR
SCHEMBL28015073 0.80 TDP1 (0.36) TDP1TSHR
Hydrochloric Acid SCHEMBL29715766 0.79 TDP1 (0.35) TDP1TSHR
SCHEMBL13005845 0.73 HCAR2 (0.39) TDP1TSHR
SCHEMBL21227585 0.69 TDP1 (0.36) TDP1TSHR
SCHEMBL27958473 0.68 MEN1 (0.35) TDP1TSHR
SCHEMBL21703593 0.68 HCAR3 (0.40) TDP1TSHR
SCHEMBL15156842 0.67
SCHEMBL31043688 0.66
SCHEMBL20689278 0.66 TDP1 (0.36) TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854788-B1 METHOD FOR PRODUCING 1-SUBSTITUTED-3-FLUOROALKYL PYRAZOLE-4-CARBOXYLATE SAGAMI CHEM RES (JP) 2012-06-13 EP disclosed
US-7863460-B2 Process for producing 1-substituted-3-fluoroalkylpyrazole-4-carboxylate SAGAMI CHEMICAL RESEARCH CENTER (JP) 2011-01-04 US disclosed
US-20080154045-A1 Process for Producing 1-Substituted-3-Fluoroalkylpyrazole-4-Carboxylate SAGAMI CHEMICAL RESEARCKH CENTER (JP) 2008-06-26 US 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-20080154045-A1 Process for Producing 1-Substituted-3-Fluoroalkylpyrazole-4-Carboxylate CYP4Z1, CYP3A4, HACL2 TDP1 3223/4885TSHR 3048/4885

“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.