SCHEMBL844173

SCHEMBL844173

NC(=O)N/N=C(\C=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.59
▸ LMNA P02545 1/20 0.59
▸ MAPT P10636 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ EGFR P00533 10/20 0.46
▸ TDP1 Q9NUW8 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ FURIN P09958 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ PMP22 Q01453 1/20 0.42

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 1.00 ALDH1A1 (0.59) ALDH1A1LMNAMAPTL3MBTL1GAA
SCHEMBL837814 1.00 ALDH1A1 (0.59) ALDH1A1LMNAMAPTL3MBTL1GAA
SCHEMBL837625 0.79 ALDH1A1 (0.39) ALDH1A1LMNAMAPTL3MBTL1GAA
Diphenylsemicarbazone SCHEMBL29448015 0.77 ALDH1A1 (0.67) ALDH1A1LMNAMAPTL3MBTL1GAA
SCHEMBL1482908 0.76 ALDH1A1 (0.48) ALDH1A1LMNAMAPTL3MBTL1GAA
Phenyl(Methyl)Semicarbazone SCHEMBL17119918 0.74 ALDH1A1 (1.00) ALDH1A1LMNAMAPTL3MBTL1GAA
SCHEMBL21283631 0.74 ALDH1A1 (0.45) ALDH1A1LMNAMAPTL3MBTL1GAA
SCHEMBL3277615 0.74 ALDH1A1 (0.45) ALDH1A1LMNAMAPTL3MBTL1GAA
Phenyl(Methyl)Semicarbazone SCHEMBL28048924 0.74 ALDH1A1 (1.00) ALDH1A1LMNAMAPTL3MBTL1GAA
Phenyl(Methyl)Semicarbazone SCHEMBL27835565 0.74 ALDH1A1 (1.00) ALDH1A1LMNAMAPTL3MBTL1GAA

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 13 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-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-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-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-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-7683060-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2010-03-23 — — US disclosed
WO-2008021781-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-02-21 — — WO disclosed
US-20080039457-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-02-14 — — 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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