SCHEMBL6338531

SCHEMBL6338531

CCC(Oc1cc2ncc(C#N)c(Cl)c2cc1OC)C1CCCNC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 17/20 0.42
▸ ABL1 P00519 5/20 0.40
▸ BCR P11274 2/20 0.40
▸ EGFR P00533 2/20 0.39
▸ ABL2 P42684 3/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.39
▸ ERBB2 P04626 1/20 0.38

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
SCHEMBL6344434 0.90 SRC (0.42) SRCEGFREHMT2ERBB2
SCHEMBL6336432 0.86 EHMT2 (0.39) EGFREHMT2ERBB2
SCHEMBL6336693 0.83 EGFR (0.39) EGFREHMT2ERBB2
SCHEMBL6337395 0.81 KDM4E (0.45) EHMT2
SCHEMBL6338533 0.79 SRC (0.51) SRCABL1BCREGFRABL2
SCHEMBL6343095 0.77 IRAK4 (0.38) EGFREHMT2ERBB2
SCHEMBL6688486 0.76 SRC (0.58) SRCABL1BCREGFRERBB2
SCHEMBL1893090 0.75 SRC (0.62) SRCABL1BCREGFRERBB2
SCHEMBL29590073 0.75 SRC (0.62) SRCABL1BCREGFRERBB2
SCHEMBL5459297 0.73 SRC (0.62) SRCABL1BCREGFRERBB2

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-6960580-B2 Nitrogenous heterocyclic substituted quinoline compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-11-01 — — US disclosed
EP-1490362-A2 (HOMO)PIPERAZINE SUBSTITUTED QUINOLINES FOR INHIBITING THE PHOSPHORYLATION OF KINASES Millennium Pharmaceuticals, Inc. (US) 2004-12-29 — — EP disclosed
US-20030004158-A1 Nitrogen containing heterocyclic quinoline compounds MILLENNIUM PHARMACEUTICALS, INC. 2003-01-02 — — US disclosed
WO-2002072578-A2 (HOMO) PIPERAZINE SUBSTITUTED QUINOLINES FOR INHIBITING THE PHOSPHORYLATION OF KINASES MILLENNIUM PHARMACEUTICALS (US) 2002-09-19 — — 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-20030004158-A1 Nitrogen containing heterocyclic quinoline compounds WNK2, PDGFA, PDGFRA SRC 228/4885ABL1 14/4885BCR 1091/4885

“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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