SCHEMBL1992349

SCHEMBL1992349

C[CH]c1ncccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 10/20 0.47
LMNA P02545 1/20 0.41
EPHX2 P34913 1/20 0.40
GAA P10253 2/20 0.36
SLC22A12 Q96S37 1/20 0.35
DHODH Q02127 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL17317193 0.80 NFE2L2 (0.44) NFE2L2LMNAEPHX2GAA
SCHEMBL586118 0.80 NFE2L2 (0.48) NFE2L2LMNAEPHX2
SCHEMBL2092601 0.79 NFE2L2 (0.50) NFE2L2LMNAEPHX2SLC22A12
SCHEMBL13536877 0.78 NFE2L2 (0.49) NFE2L2LMNAEPHX2GAA
SCHEMBL4762123 0.77 NFE2L2 (0.48) NFE2L2LMNAEPHX2GAA
SCHEMBL14686364 0.77 NFE2L2 (0.51) NFE2L2SLC22A12
SCHEMBL27841616 0.76 LMNA (0.44) NFE2L2LMNAEPHX2GAA
SCHEMBL12472261 0.76 LMNA (0.44) NFE2L2LMNAEPHX2GAA
SCHEMBL20283188 0.74 NFE2L2 (0.46) NFE2L2LMNAGAAMAPK1
SCHEMBL6398468 0.74 NFE2L2 (0.46) NFE2L2LMNAEPHX2GAACYP1A2

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
WO-2024071216-A1 PYRAZOLE COMPOUND AND PEST CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT 三井化学クロップ&ライフソリューション株式会社 2024-04-04 WO disclosed
WO-2023171783-A1 PYRAZOLE COMPOUND, AND NOXIOUS ORGANISM CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT 三井化学アグロ株式会社 2023-09-14 WO disclosed
US-20140018377-A1 Aminopropenoates as Fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-16 US disclosed
US-8476197-B2 Aminopropenoates as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-02 US disclosed
US-20110152322-A1 Aminopropenoates as Fungicides BAYER CROPSCIENCE AG (DE) 2011-06-23 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 (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-20110152322-A1 Aminopropenoates as Fungicides AASDHPPT, DAO, AAAS NFE2L2 3979/4885LMNA 1991/4885EPHX2 933/4885
US-20140018377-A1 Aminopropenoates as Fungicides ACMSD, AASDHPPT, AAAS NFE2L2 3719/4885LMNA 2687/4885EPHX2 2290/4885

“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.