Methane

Methane

SCHEMBL5123634

C.COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1O

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 16/20 0.72
▸ KDR P35968 4/20 0.71
▸ RET P07949 3/20 0.71
▸ KIF5B P33176 3/20 0.71
▸ KCNH2 Q12809 1/20 0.61
▸ ERBB2 P04626 1/20 0.61
▸ FLT1 P17948 1/20 0.61
▸ EPHA2 P29317 1/20 0.61
▸ EPHB4 P54760 1/20 0.61

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
SCHEMBL202827 0.99 EGFR (0.73) EGFRKDRRETKIF5BKCNH2
SCHEMBL29781309 0.99 EGFR (0.73) EGFRKDRRETKIF5BKCNH2
SCHEMBL2456254 0.95 RET (0.72) EGFRKDRRETKIF5BERBB2
SCHEMBL10100955 0.90 KDR (0.75) EGFRKDRRETKIF5BKCNH2
Hydrochloric Acid SCHEMBL4558015 0.89 EGFR (0.67) EGFRKDRRETKIF5BERBB2
SCHEMBL3690394 0.87 EGFR (0.58) EGFRKDRRETKIF5BKCNH2
SCHEMBL16016709 0.87 EGFR (0.67) EGFRKDRRETKIF5BKCNH2
SCHEMBL13604777 0.86 EGFR (0.69) EGFRKDRRETKIF5BKCNH2
SCHEMBL16075710 0.86 EGFR (0.70) EGFRKDRRETKIF5BFLT1
SCHEMBL21541701 0.86 EGFR (0.66) EGFRKDRRETKIF5BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234263-A1 Quinazoline Derivatives ASTRAZENECA (SE) 2008-09-25 — — US disclosed
EP-1664030-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-06-07 — — EP disclosed
WO-2005026156-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-03-24 — — 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-20080234263-A1 Quinazoline Derivatives EGFR, ERBB2, ERBB3 EGFR 1/4885KDR 137/4885RET 35/4885

“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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