SCHEMBL23581207

SCHEMBL23581207

C=CC(=O)Nc1cc(N2CCN(C)CC2)ccc1Nc1ncc(C#N)c(Nc2ccccc2OC(C)C)n1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 3/20 0.61
▸ EGFR P00533 3/20 0.58
▸ SRC P12931 5/20 0.56
▸ MAP3K7 O43318 6/20 0.55
▸ MAPK1 P28482 4/20 0.55
▸ MAP2K1 Q02750 4/20 0.55
▸ FGFR1 P11362 3/20 0.55
▸ MAPK3 P27361 3/20 0.55
▸ SLC2A1 P11166 1/20 0.53
▸ FLT3 P36888 1/20 0.52

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
SCHEMBL23606823 0.94 MAPK3 (0.54) JAK3EGFRSRCMAP3K7MAPK1
SCHEMBL30331238 0.94 MAPK3 (0.54) JAK3EGFRSRCMAP3K7MAPK1
SCHEMBL30044417 0.93 ALK (0.60) JAK3EGFRSRCMAP3K7MAPK1
SCHEMBL30045121 0.93 ALK (0.56) JAK3EGFRSRCMAP3K7FGFR1
SCHEMBL25139826 0.93 ALK (0.56) JAK3EGFRSRCMAP3K7FGFR1
SCHEMBL25139831 0.93 ALK (0.60) JAK3EGFRSRCMAP3K7MAPK1
SCHEMBL25140070 0.92 JAK3 (0.54) JAK3EGFRSRCMAP3K7MAPK1
SCHEMBL25139771 0.90 PLK1 (0.60) JAK3EGFRFGFR1MAPK3
SCHEMBL25139800 0.90 PLK1 (0.55) JAK3EGFRSRCFGFR1MAPK3
SCHEMBL30043654 0.90 PLK1 (0.60) JAK3EGFRFGFR1MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125046-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2023-04-20 — — US disclosed
CN-113087671-B Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2022-10-21 — — CN disclosed
CN-113087671-A Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof 北京赛特明强医药科技有限公司 2021-07-09 — — CN disclosed
WO-2021129561-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 北京赛特明强医药科技有限公司 2021-07-01 — — WO disclosed
WO-2021129561-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 北京赛特明强医药科技有限公司 2021-07-01 — — 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-20230125046-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF FGFR4, FGFR1, WEE1 JAK3 372/4885EGFR 561/4885SRC 131/4885

“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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