SCHEMBL16207128

SCHEMBL16207128

C=CC(=O)Nc1ccc(OC)c(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)c(C(N)=O)nc2CC)c1

nearest known ligand 0.84

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.84
▸ EML4 Q9HC35 4/20 0.52
▸ ALK Q9UM73 4/20 0.52
▸ RET P07949 2/20 0.52
▸ ROS1 P08922 2/20 0.52
▸ FLT3 P36888 2/20 0.52
▸ MAP3K7 O43318 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ MAP2K1 Q02750 1/20 0.51

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
SCHEMBL16206994 0.92 EGFR (0.84) EGFREML4ALKRETROS1
SCHEMBL16196020 0.92 EGFR (1.00) EGFREML4ALKRETROS1
SCHEMBL16207132 0.92 EGFR (0.83) EGFREML4ALKRETROS1
SCHEMBL16207129 0.90 EGFR (0.77) EGFRMAP3K7MAPK1MAP2K1
SCHEMBL16207157 0.90 EGFR (0.80) EGFREML4ALKRETROS1
SCHEMBL16207329 0.89 EGFR (0.84) EGFREML4ALKRETROS1
SCHEMBL16195522 0.89 EGFR (1.00) EGFR
SCHEMBL16206921 0.88 EGFR (0.65) EGFREML4ALKRETROS1
SCHEMBL16207152 0.88 EGFR (0.80) EGFREML4ALKRETROS1
SCHEMBL16207000 0.87 EGFR (0.87) EGFREML4ALKFLT3MAP3K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9085540-B2 Pyrazinecarboxamide compound ASTELLAS PHARMA INC. (JP) 2015-07-21 — — US disclosed
US-9085540-B2 Pyrazinecarboxamide compound ASTELLAS PHARMA INC. (JP) 2015-07-21 — — US disclosed
US-20140323463-A1 PYRAZINECARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-10-30 — — US disclosed
US-20140323463-A1 PYRAZINECARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-10-30 — — 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-20140323463-A1 PYRAZINECARBOXAMIDE COMPOUND EGFR, ERBB2, ALK EGFR 1/4885EML4 158/4885ALK 3/4885

“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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