SCHEMBL16207126

SCHEMBL16207126

C=CC(=O)Nc1cc(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)c(C(N)=O)nc2CC)c(Cl)cc1Cl

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.76
▸ MAP3K7 O43318 4/20 0.53
▸ MAP2K1 Q02750 3/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ FLT3 P36888 2/20 0.53
▸ EML4 Q9HC35 2/20 0.51
▸ ALK Q9UM73 2/20 0.51
▸ FGFR1 P11362 1/20 0.51
▸ SRC P12931 1/20 0.51
▸ RET P07949 1/20 0.51
▸ ROS1 P08922 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
SCHEMBL16207132 0.92 EGFR (0.83) EGFRMAP3K7MAP2K1FLT3EML4
SCHEMBL16207039 0.91 EGFR (0.78) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16207032 0.89 EGFR (0.85) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16207123 0.89 EGFR (0.84) EGFRMAP3K7FLT3EML4ALK
SCHEMBL16207000 0.89 EGFR (0.87) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16206913 0.87 EGFR (0.64) EGFRFLT3EML4ALKRET
SCHEMBL16195490 0.87 EGFR (1.00) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16206994 0.86 EGFR (0.84) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16207128 0.86 EGFR (0.84) EGFRMAP3K7MAP2K1MAPK1FLT3
SCHEMBL16207129 0.86 EGFR (0.77) EGFRMAP3K7MAP2K1MAPK1

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-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
EP-2805940-A1 PYRAZINE CARBOXAMIDE COMPOUND Astellas Pharma Inc. (JP) 2014-11-26 — — EP 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 1/4885MAP3K7 269/4885MAP2K1 734/4885

“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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