SCHEMBL1642894

SCHEMBL1642894

Cc1cc2cc(Nc3nc(Br)cnc3N)ccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.56
▸ VCP P55072 5/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ KEAP1 Q14145 1/20 0.48
▸ KDR P35968 3/20 0.45
▸ FLT1 P17948 1/20 0.45
▸ FGFR2 P21802 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ CDK1 P06493 1/20 0.43
▸ SYK P43405 1/20 0.42
▸ MAOA P21397 3/20 0.40
▸ MAOB P27338 3/20 0.40
▸ PRKCQ Q04759 2/20 0.39
▸ PRKCD Q05655 1/20 0.39
▸ ROCK2 O75116 1/20 0.38
▸ MKNK1 Q9BUB5 1/20 0.37

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
SCHEMBL1640841 0.81 FGFR2 (0.69) EGFRVCPCYP2A6KEAP1KDR
SCHEMBL1641747 0.79 FGFR2 (0.67) EGFRKDRFLT1FGFR2FLT3
SCHEMBL1642543 0.79 MKNK1 (0.60) EGFRFGFR2FLT3SYKROCK2
SCHEMBL1642784 0.79 FGFR2 (0.54) EGFRVCPKDRFLT1FGFR2
SCHEMBL1640855 0.77 FGFR2 (0.50) EGFRVCPKDRFLT1FGFR2
SCHEMBL29393606 0.75 CDK1 (0.49) EGFRFGFR2FLT3CDK1MKNK1
SCHEMBL12065998 0.74 EGFR (0.52) EGFR
Trifluoroacetic Acid SCHEMBL27909280 0.73 FGFR2 (0.58) EGFRVCPKDRFLT1FGFR2
SCHEMBL879565 0.73 EGFR (0.51) EGFRVCPCYP2A6KEAP1KDR
Trifluoroacetic Acid SCHEMBL27927102 0.72 ATR (0.49) VCPKDRFGFR2FLT3CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2671876-A2 Pyrazine derivatives and their use as protein kinase inhbitors Akinion Pharmaceuticals AB (SE) 2013-12-11 — — EP disclosed
US-20130203774-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF AKINION PHARMACEUTICALS AB (SE) 2013-08-08 — — US disclosed
US-8436171-B2 Amino substituted pyrazines as inhibitors or protein kinases AKINION PHARMACEUTICALS AB (SE) 2013-05-07 — — US disclosed
US-20110098310-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF BIOVITRUM AB (SE) 2011-04-28 — — US disclosed
EP-2252597-A2 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF Akinion Pharmaceuticals AB (SE) 2010-11-24 — — EP disclosed
WO-2009095399-A2 PYRAZINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHBITORS AKINION PHARMACEUTICALS AB (SE) 2009-08-06 — — 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 (2 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-20130203774-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF FLT3, MLLT1, MYD88 EGFR 298/4885VCP 4751/4885CYP2A6 3240/4885
US-20110098310-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF FLT3, MLLT1, MYD88 EGFR 298/4885VCP 4751/4885CYP2A6 3240/4885

“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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