SCHEMBL4376291

SCHEMBL4376291

COc1cc2c(Nc3ccc4cc[nH]c4c3)ncnc2cc1O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 7/20 0.84
KDR P35968 7/20 0.64
KIF5B P33176 4/20 0.64
EGFR P00533 9/20 0.61
RIPK2 O43353 2/20 0.60
JAK3 P52333 2/20 0.60
GAK O14976 1/20 0.60
STK10 O94804 1/20 0.60
FLT3 P36888 1/20 0.60
AAK1 Q2M2I8 1/20 0.60
Q6ZSR9 Q6ZSR9 1/20 0.60
SLK Q9H2G2 1/20 0.60
IRAK4 Q9NWZ3 1/20 0.60
RPS6KA6 Q9UK32 1/20 0.60
ALK Q9UM73 1/20 0.60
LCK P06239 3/20 0.58
ABCG2 Q9UNQ0 2/20 0.57
ABCB1 P08183 1/20 0.57
NOD1 Q9Y239 1/20 0.57
AURKB Q96GD4 2/20 0.57

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
SCHEMBL4383397 0.92 RET (0.70) RETKDRKIF5BEGFRRIPK2
SCHEMBL8976728 0.91 RET (1.00) RETKDRKIF5BEGFRRIPK2
Hydrochloric Acid SCHEMBL4377353 0.91 RET (0.69) RETKDRKIF5BEGFRRIPK2
SCHEMBL15052504 0.87 BRAF (0.76) RETEGFRRAF1BRAF
SCHEMBL11953092 0.86 RET (0.67) RETKDRKIF5BEGFRRIPK2
SCHEMBL6030630 0.83 RET (0.58) RETKDRKIF5BEGFRRIPK2
SCHEMBL8561433 0.82 RET (0.83) RETKDRKIF5BEGFRRIPK2
SCHEMBL20792806 0.81 EGFR (0.87) RETKDRKIF5BEGFRRIPK2
Hydrochloric Acid SCHEMBL4371602 0.81 RET (0.80) RETKDREGFRRIPK2LCK
Hydrochloric Acid SCHEMBL8904802 0.81 RET (0.81) RETKDRKIF5BEGFRRIPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 US disclosed
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-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 US disclosed
EP-2050744-A1 Quinazoline derivatives as angiogenesis inhibitors AstraZeneca AB (SE) 2009-04-22 EP disclosed
EP-2050744-A1 Quinazoline derivatives as angiogenesis inhibitors AstraZeneca AB (SE) 2009-04-22 EP 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-1553097-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AND INTERMEDIATES THEREFORE AstraZeneca AB (SE) 2005-07-13 EP disclosed
EP-1154774-B1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-06-22 EP 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 RET 637/4885KDR 3/4885KIF5B 1611/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 RET 1047/4885KDR 4/4885KIF5B 3583/4885

“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.