SCHEMBL4371957

SCHEMBL4371957

COc1cc2ncnc(Oc3ccc4[nH]c(Nc5ccc(Cl)c(OC(C)C6CCNCC6)c5)nc4c3)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 16/20 0.58
▸ EPHA2 P29317 5/20 0.41
▸ EPHB4 P54760 5/20 0.41
▸ EGFR P00533 2/20 0.41
▸ BRAF P15056 2/20 0.41
▸ RAF1 P04049 1/20 0.41
▸ LCK P06239 1/20 0.40
▸ PDGFRA P16234 2/20 0.40
▸ KIT P10721 1/20 0.40
▸ ERBB2 P04626 2/20 0.40
▸ FLT1 P17948 1/20 0.39

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
SCHEMBL4364221 0.81 KDR (0.59) KDREGFR
SCHEMBL4365461 0.80 KDR (0.86) KDREGFRBRAFLCKPDGFRA
SCHEMBL7847135 0.77 KDR (0.45) KDREGFRLCKPDGFRAKIT
SCHEMBL4367885 0.77 KDR (0.66) KDREPHA2EPHB4EGFRBRAF
SCHEMBL5790844 0.77 KDR (0.66) KDREPHA2EPHB4EGFRBRAF
SCHEMBL6366468 0.76 KDR (0.43) KDREGFRLCKPDGFRAKIT
SCHEMBL7846902 0.76 KDR (0.45) KDREGFRRAF1LCKPDGFRA
SCHEMBL7845204 0.75 KDR (0.45) KDREGFRBRAFRAF1LCK
Hydrochloric Acid SCHEMBL7853846 0.70 RET (0.52) KDREPHA2EPHB4EGFRLCK
SCHEMBL7850002 0.70 KDR (0.43) KDREPHB4EGFRBRAFLCK

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-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 — — US disclosed
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 — — EP disclosed
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 — — US disclosed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 — — 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-20040209892-A1 Heterocyclic compounds and methods of use VHL, NQO1, HPGDS KDR 83/4885EPHA2 2583/4885EPHB4 1820/4885

“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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