SCHEMBL483559

SCHEMBL483559

CNC(=O)C(=NOC)c1ccccc1CO/N=C(\C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.52
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
RXFP1 Q9HBX9 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL123529 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL30354029 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL123530 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL29765420 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL14141835 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL828172 1.00 HIF1A (0.52) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL30158137 0.92 MEN1 (0.45) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL13278820 0.92 MEN1 (0.45) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL168688 0.92 MEN1 (0.45) HIF1AMEN1KMT2AGAAPPARG
SCHEMBL168689 0.92 MEN1 (0.45) HIF1AMEN1KMT2AGAAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090280981-A1 SYNERGISTIC ACTIVE INGREDIENT COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-11-12 US claimed
WO-2016055096-A1 METHOD FOR TREATING RICE SEED BAYER CROPSCIENCE AG (DE) 2016-04-14 WO disclosed
EP-2699093-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING A (THIO)CARBOXAMIDE DERIVATIVE AND A FUNGICIDAL COMPOUND Bayer Intellectual Property GmbH (DE) 2014-02-26 EP disclosed
WO-2012143127-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING A (THIO)CARBOXAMIDE DERIVATIVE AND A FUNGICIDAL COMPOUND BAYER CROPSCIENCES AG (DE) 2012-10-26 WO disclosed
EP-2443090-A1 SUBSTITUTED ENAMINO CARBONYL COMPOUNDS Bayer Cropscience AG (DE) 2012-04-25 EP disclosed
EP-2410850-A2 SYNERGISTIC COMBINATIONS OF ACTIVE INGREDIENTS Bayer Cropscience AG (DE) 2012-02-01 EP disclosed
WO-2010145764-A1 SUBSTITUTED ENAMINO CARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2010-12-23 WO disclosed
WO-2010108507-A2 SYNERGISTIC COMBINATIONS OF ACTIVE INGREDIENTS BAYER CROPSCIENCE AG (DE) 2010-09-30 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-20090280981-A1 SYNERGISTIC ACTIVE INGREDIENT COMBINATIONS CYP51A1, ERG28, CYP4X1 HIF1A 4728/4885MEN1 2860/4885KMT2A 2897/4885

“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.