SCHEMBL837625

SCHEMBL837625

NC(=O)NN=C(C=O)c1ccccc1.O=c1ncc(-c2ccccc2)n[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 3/20 0.37
▸ GAA P10253 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ FAAH O00519 2/20 0.37
▸ IKBKB O14920 1/20 0.36
▸ EGFR P00533 2/20 0.35
▸ TP53 P04637 3/20 0.34
▸ PIM1 P11309 3/20 0.34
▸ CHEK1 O14757 2/20 0.34
▸ GSK3B P49841 2/20 0.34
▸ RPS6KA3 P51812 2/20 0.34
▸ LIMK1 P53667 2/20 0.34
▸ CDK5 Q00535 2/20 0.34
▸ AURKB Q96GD4 2/20 0.34
▸ CLK4 Q9HAZ1 2/20 0.34
▸ RET P07949 1/20 0.34
▸ PDGFRB P09619 1/20 0.34
▸ PDGFRA P16234 1/20 0.34

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
SCHEMBL837813 0.79 ALDH1A1 (0.59) ALDH1A1LMNAMAPTGAAL3MBTL1
SCHEMBL837814 0.79 ALDH1A1 (0.59) ALDH1A1LMNAMAPTGAAL3MBTL1
SCHEMBL844173 0.79 ALDH1A1 (0.59) ALDH1A1LMNAMAPTGAAL3MBTL1
SCHEMBL835685 0.74 CYP1A2 (0.55) ALDH1A1GAAL3MBTL1TP53PIM1
SCHEMBL7229988 0.66 RARB (0.48) ALDH1A1TP53CHEK1DYRK1BKDM4E
SCHEMBL836395 0.62 MAPK1 (0.51) ALDH1A1LMNAMAPTGAAL3MBTL1
Diphenylsemicarbazone SCHEMBL29448015 0.61 ALDH1A1 (0.67) ALDH1A1LMNAMAPTGAAL3MBTL1
SCHEMBL837449 0.60 CA12 (0.47) MAPTRETMAPK14MAPK1KDR
SCHEMBL1482908 0.60 ALDH1A1 (0.48) ALDH1A1LMNAMAPTGAAL3MBTL1
SCHEMBL4250955 0.59 IDO1 (0.57) LMNAMAPTTP53PIM1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143251-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2012-03-27 — — US disclosed
US-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION 2011-06-16 — — US disclosed
US-7915408-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2011-03-29 — — US disclosed
US-20100130467-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION 2010-05-27 — — US disclosed
US-7683060-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2010-03-23 — — US disclosed
US-20080039457-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-02-14 — — 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 (3 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-20080039457-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET ALDH1A1 2912/4885LMNA 4236/4885MAPT 909/4885
US-20100130467-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET ALDH1A1 2912/4885LMNA 4236/4885MAPT 909/4885
US-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET ALDH1A1 2912/4885LMNA 4236/4885MAPT 909/4885

“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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