SCHEMBL6031625

SCHEMBL6031625

CCN(CC)CC(O)COc1cc2ncnc(Oc3ccc4[nH]c(C)cc4c3)c2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.44
▸ EGFR P00533 4/20 0.44
▸ RET P07949 3/20 0.43
▸ KIF5B P33176 1/20 0.43
▸ MET P08581 3/20 0.43
▸ TEK Q02763 3/20 0.43
▸ AURKB Q96GD4 3/20 0.43
▸ AURKA O14965 2/20 0.43
▸ KDM1A O60341 1/20 0.43
▸ KIT P10721 2/20 0.43
▸ PDGFRA P16234 2/20 0.43
▸ FLT1 P17948 2/20 0.43
▸ FLT4 P35916 2/20 0.43
▸ LCK P06239 2/20 0.43
▸ PLK4 O00444 1/20 0.43
▸ GAK O14976 1/20 0.43
▸ EPHB6 O15197 1/20 0.43
▸ RIPK2 O43353 1/20 0.43
▸ ERN1 O75460 1/20 0.43
▸ STK10 O94804 1/20 0.43

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
SCHEMBL6099355 1.00 KDR (0.44) KDREGFRRETKIF5BMET
SCHEMBL6029734 0.85 KDM1A (0.51) KDREGFRRETMETTEK
SCHEMBL4380776 0.85 ABCB11 (0.48) KDREGFRRETKIF5BMET
SCHEMBL4382153 0.85 ABCB11 (0.48) KDREGFRRETKIF5BMET
SCHEMBL4380783 0.85 ABCB11 (0.48) KDREGFRRETKIF5BMET
SCHEMBL4371119 0.84 KDR (0.54) KDREGFRRETMETTEK
SCHEMBL4371127 0.84 KDR (0.54) KDREGFRRETMETTEK
SCHEMBL4386304 0.84 KDR (0.54) KDREGFRRETMETTEK
SCHEMBL4378619 0.83 ABCB11 (0.55) KDREGFRRETMETTEK
SCHEMBL4374832 0.83 BRAF (0.55) KDREGFRRETMETTEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074800-B1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2006-07-11 — — US claimed
EP-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 — — EP claimed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 — — WO claimed
US-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 — — US disclosed
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 — — US disclosed
US-7074800-B1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2006-07-11 — — US disclosed
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB 2006-01-05 — — US disclosed
EP-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 — — EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 — — 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-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, FLT1, KDR KDR 3/4885EGFR 500/4885RET 637/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 KDR 4/4885EGFR 549/4885RET 1047/4885

“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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