SCHEMBL4970955

SCHEMBL4970955

COc1cc2c(Nc3cc(N)ccc3C)ncnc2cc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 13/20 0.68
KDR P35968 13/20 0.68
KIF5B P33176 8/20 0.68
BRAF P15056 3/20 0.62
RAF1 P04049 2/20 0.62
EGFR P00533 4/20 0.57
GAK O14976 1/20 0.57
RIPK2 O43353 1/20 0.57
STK10 O94804 1/20 0.57
FLT3 P36888 1/20 0.57
JAK3 P52333 1/20 0.57
AAK1 Q2M2I8 1/20 0.57
Q6ZSR9 Q6ZSR9 1/20 0.57
SLK Q9H2G2 1/20 0.57
IRAK4 Q9NWZ3 1/20 0.57
RPS6KA6 Q9UK32 1/20 0.57
ALK Q9UM73 1/20 0.57
FGFR1 P11362 1/20 0.56
FLT1 P17948 1/20 0.56
LCK P06239 1/20 0.56

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
SCHEMBL6793966 0.91 KDR (0.74) RETKDRKIF5BEGFRRIPK2
SCHEMBL6675906 0.86 KDR (0.73) RETKDRKIF5BBRAFRAF1
SCHEMBL27782657 0.85 RET (0.72) RETKDRKIF5BEGFRGAK
SCHEMBL5004836 0.82 ABCG2 (0.64) RETKDRKIF5BBRAFRAF1
SCHEMBL6674055 0.81 KDR (0.82) RETKDRKIF5BBRAFRAF1
SCHEMBL18158909 0.81 RET (1.00) RETKDRKIF5BBRAFRAF1
SCHEMBL14159636 0.81 KDR (0.73) RETKDRKIF5BEGFRGAK
SCHEMBL20792806 0.79 EGFR (0.87) RETKDRKIF5BBRAFRAF1
SCHEMBL13604745 0.79 EGFR (0.82) RETKDRKIF5BBRAFRAF1
SCHEMBL7215803 0.78 KDR (0.89) RETKDRKIF5BBRAFRAF1

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-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents ASTRAZENECA AB (SE) 2008-12-11 US disclosed
EP-1966159-A2 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2008-09-10 EP disclosed
WO-2007071963-A2 QUINAZOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTI-CANCER AGENTS ASTRAZENECA AB (SE) 2007-06-28 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-20080306096-A1 Quinazoline Derivatives, Process for Their Preparation and Their Use as Anti-Cancer Agents BRAF, RAF1, NRAS RET 469/4885KDR 1051/4885KIF5B 1393/4885

“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.