SCHEMBL2131550

SCHEMBL2131550

[2H]C([2H])([2H])N(C/C=C/C(=O)Nc1cc2c(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c(C#N)cnc2cc1OCCOC)C([2H])([2H])[2H]

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.81
▸ ERBB2 P04626 20/20 0.81

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
Hki-357 SCHEMBL2134691 0.93 EGFR (0.93) EGFRERBB2
Hki-357 SCHEMBL2129079 0.92 EGFR (0.94) EGFRERBB2
Hki-357 SCHEMBL29351364 0.90 EGFR (1.00) EGFRERBB2
Hki-357 SCHEMBL2203420 0.90 EGFR (1.00) EGFRERBB2
Hki-357 SCHEMBL29351355 0.90 EGFR (1.00) EGFRERBB2
Hki-357 SCHEMBL2203413 0.90 EGFR (1.00) EGFRERBB2
Hki-357 SCHEMBL29478857 0.90 EGFR (1.00) EGFRERBB2
SCHEMBL2131589 0.88 EGFR (0.83) EGFRERBB2
SCHEMBL18949451 0.88 EGFR (0.87) EGFRERBB2
SCHEMBL2129464 0.87 EGFR (0.81) EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748453-B2 Substituted heterocyclic compounds as kinases inhibitors and methods of use thereof MEDOLUTION LIMITED (HK) 2014-06-10 — — US claimed
EP-2445885-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHOD OF USE THEREOF Medolution Limited (CN) 2012-05-02 — — EP claimed
US-20120101116-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHODS OF USE THEREOF MEDOLUTION LIMITED (US) 2012-04-26 — — US claimed
WO-2010151710-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHOD OF USE THEREOF MEDOLUTION LIMITED (CN) 2010-12-29 — — WO claimed
US-8748453-B2 Substituted heterocyclic compounds as kinases inhibitors and methods of use thereof MEDOLUTION LIMITED (HK) 2014-06-10 — — US disclosed
EP-2445885-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHOD OF USE THEREOF Medolution Limited (CN) 2012-05-02 — — EP disclosed
US-20120101116-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHODS OF USE THEREOF MEDOLUTION LIMITED (US) 2012-04-26 — — US disclosed
WO-2010151710-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHOD OF USE THEREOF MEDOLUTION LIMITED (CN) 2010-12-29 — — 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-20120101116-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS KINASES INHIBITORS AND METHODS OF USE THEREOF MAP4K2, MAP3K7, MAP3K1 EGFR 1263/4885ERBB2 464/4885

“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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