SCHEMBL3218786

SCHEMBL3218786

NC(=O)C1=C[N]c2cccc(-c3nnn[nH]3)c21

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.31
TYRO3 Q06418 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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
SCHEMBL2650295 0.74 CSNK1A1 (0.54) CSNK1A1TYRO3DYRK1BKEAP1NFE2L2
SCHEMBL3914170 0.74 CSNK1A1 (0.44) CSNK1A1TYRO3DYRK1BKEAP1NFE2L2
SCHEMBL14313208 0.72 PIM1 (0.38)
SCHEMBL3222329 0.71 BCAT2 (0.38) CSNK1A1TYRO3DYRK1BKEAP1NFE2L2
SCHEMBL3218782 0.71
SCHEMBL28665677 0.69 BCAT2 (0.51) CSNK1A1TYRO3DYRK1BKEAP1NFE2L2
SCHEMBL3344539 0.69 PARP1 (0.39) CSNK1A1TYRO3DYRK1BKEAP1NFE2L2
SCHEMBL6231660 0.69 ALDH1A1 (0.41)
SCHEMBL17478606 0.68 MKNK1 (0.38) CSNK1A1TYRO3DYRK1B
SCHEMBL3225838 0.67 KDM4E (0.35)

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-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 US claimed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 US claimed
US-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 US disclosed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 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-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS HRH2, HRH1, HRH4 CSNK1A1 1855/4885TYRO3 4243/4885DYRK1B 3563/4885

“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.