SCHEMBL23606378

SCHEMBL23606378

C=CC(=O)Nc1cc(N2CCC(N3CCCC3)CC2)c(F)cc1Nc1ncc(C#N)c(Nc2ccccc2OC(C)C)n1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 2/20 0.50
▸ MAPK3 P27361 6/20 0.45
▸ ALK Q9UM73 5/20 0.44
▸ INSR P06213 4/20 0.44
▸ IGF1R P08069 3/20 0.44
▸ JAK3 P52333 2/20 0.42
▸ EGFR P00533 6/20 0.41
▸ BTK Q06187 2/20 0.41
▸ FGFR1 P11362 1/20 0.41
▸ FGFR2 P21802 1/20 0.41
▸ FGFR4 P22455 1/20 0.41
▸ FGFR3 P22607 1/20 0.41

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
SCHEMBL30044353 1.00 PLK1 (0.50) PLK1MAPK3ALKINSRIGF1R
SCHEMBL25139867 0.99 PLK1 (0.49) PLK1MAPK3ALKINSRIGF1R
SCHEMBL30044360 0.95 ALK (0.50) PLK1MAPK3ALKINSRIGF1R
SCHEMBL25139843 0.95 ALK (0.50) PLK1MAPK3ALKINSRIGF1R
SCHEMBL30045137 0.94 EGFR (0.48) PLK1MAPK3ALKINSRIGF1R
SCHEMBL25139873 0.94 EGFR (0.48) PLK1MAPK3ALKINSRIGF1R
SCHEMBL30044565 0.93 PLK1 (0.51) PLK1MAPK3ALKINSRIGF1R
SCHEMBL23606810 0.93 PLK1 (0.51) PLK1MAPK3ALKINSRIGF1R
SCHEMBL25139852 0.92 PLK1 (0.50) PLK1MAPK3ALKINSRIGF1R
SCHEMBL25139862 0.91 ALK (0.42) PLK1MAPK3ALKINSRIGF1R

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 2 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
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 PLK1 250/4885MAPK3 809/4885ALK 149/4885

“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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