SCHEMBL25139859

SCHEMBL25139859

C=CC(=O)Nc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(C#N)c(Nc2ccccc2S(=O)(=O)C(C)C)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 15/20 0.63
▸ INSR P06213 6/20 0.63
▸ EGFR P00533 6/20 0.63
▸ IGF1R P08069 5/20 0.63
▸ BTK Q06187 3/20 0.63
▸ FGFR1 P11362 2/20 0.63
▸ FGFR2 P21802 2/20 0.63
▸ FGFR4 P22455 2/20 0.63
▸ FGFR3 P22607 2/20 0.63
▸ BMPR1B O00238 2/20 0.63
▸ PLK4 O00444 2/20 0.63
▸ GAK O14976 2/20 0.63
▸ ERN1 O75460 2/20 0.63
▸ STK10 O94804 2/20 0.63
▸ ABL1 P00519 2/20 0.63
▸ LCK P06239 2/20 0.63
▸ FYN P06241 2/20 0.63
▸ FES P07332 2/20 0.63
▸ YES1 P07947 2/20 0.63
▸ HCK P08631 2/20 0.63

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
SCHEMBL30044572 1.00 ALK (0.63) ALKINSREGFRIGF1RBTK
SCHEMBL25139831 0.89 ALK (0.60) ALKINSREGFRIGF1RBTK
SCHEMBL30044417 0.89 ALK (0.60) ALKINSREGFRIGF1RBTK
SCHEMBL30044020 0.88 INSR (0.54) ALKINSREGFRIGF1RBTK
SCHEMBL25139876 0.88 INSR (0.54) ALKINSREGFRIGF1RBTK
SCHEMBL25139880 0.88 ALK (0.54) ALKINSREGFRIGF1RBTK
SCHEMBL30045121 0.86 ALK (0.56) ALKINSREGFRIGF1RBTK
SCHEMBL25139826 0.86 ALK (0.56) ALKINSREGFRIGF1RBTK
SCHEMBL25139832 0.84 PLK1 (0.55) ALKINSREGFRIGF1RBTK
SCHEMBL30044170 0.84 PLK1 (0.55) ALKINSREGFRIGF1RBTK

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 1 patent. 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

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 ALK 149/4885INSR 683/4885EGFR 561/4885

“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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