SCHEMBL29438459

SCHEMBL29438459

Nc1[nH]ncc1C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 1.00
▸ AHR P35869 1/20 1.00
▸ HSD17B10 Q99714 1/20 1.00
▸ EPAS1 Q99814 1/20 0.64
▸ PTGS1 P23219 1/20 0.63
▸ RXFP1 Q9HBX9 11/20 0.58
▸ P2RX1 P51575 1/20 0.57
▸ MAPT P10636 1/20 0.56
▸ LCK P06239 2/20 0.54
▸ KDR P35968 2/20 0.54
▸ KIT P10721 1/20 0.54
▸ MAPK14 Q16539 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ KMT2A Q03164 1/20 0.54

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
SCHEMBL23853488 1.00 GAA (1.00) GAAAHRHSD17B10EPAS1PTGS1
SCHEMBL29438413 0.84 HSD17B10 (0.73) GAAAHRHSD17B10PTGS1P2RX1
SCHEMBL29438464 0.83 GAA (0.71) GAAAHRHSD17B10LCKKDR
SCHEMBL29438428 0.82 GAA (0.69) GAAAHRHSD17B10EPAS1MAPT
SCHEMBL3421414 0.80 HSD17B10 (0.65) GAAAHRHSD17B10MAPTMEN1
SCHEMBL29059356 0.79 EPAS1 (0.79) GAAAHRHSD17B10EPAS1PTGS1
SCHEMBL29059173 0.78 EPAS1 (1.00) GAAAHRHSD17B10EPAS1PTGS1
SCHEMBL29438441 0.78 GAA (0.64) GAAAHRHSD17B10EPAS1MAPT
SCHEMBL31424184 0.78 PTGS1 (1.00) GAAAHRHSD17B10PTGS1RXFP1
SCHEMBL4031509 0.78 PTGS1 (1.00) GAAAHRHSD17B10PTGS1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220064167-A1 IMIDAZO-PYRAZOLE CARBOXAMIDE DERIVATIVES AS ANTICANCER AGENTS AND THE SYNTHESIS THEREOF AVIDIN KFT. (HU) 2022-03-03 — — 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-20220064167-A1 IMIDAZO-PYRAZOLE CARBOXAMIDE DERIVATIVES AS ANTICANCER AGENTS AND THE SYNTHESIS THEREOF MYD88, MCL1, MYADM GAA 4744/4885AHR 881/4885HSD17B10 4038/4885

“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.

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