SCHEMBL4374345

SCHEMBL4374345

COc1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2cc1OCCCN1CCS(=O)(=O)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.62
SRC P12931 6/20 0.57
EGFR P00533 13/20 0.57
KDR P35968 5/20 0.57
ERBB2 P04626 2/20 0.56
CIT O14578 1/20 0.55
GAK O14976 1/20 0.55
EPHB6 O15197 1/20 0.55
ABCC4 O15439 1/20 0.55
DAPK3 O43293 1/20 0.55
RIPK2 O43353 1/20 0.55
NR1I2 O75469 1/20 0.55
RPS6KA4 O75676 1/20 0.55
STK17B O94768 1/20 0.55
STK10 O94804 1/20 0.55
PRKD3 O94806 1/20 0.55
ABCB11 O95342 1/20 0.55
MAP4K4 O95819 1/20 0.55
CHEK2 O96017 1/20 0.55
ABL1 P00519 1/20 0.55

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
SCHEMBL4371016 0.95 RET (0.69) RETSRCEGFRKDRERBB2
SCHEMBL4371005 0.92 RET (0.66) RETEGFRKDRERBB2FLT4
Hydrochloric Acid SCHEMBL4380784 0.90 EGFR (0.67) RETSRCEGFRKDRERBB2
SCHEMBL4374281 0.88 RET (0.61) RETSRCEGFRKDRERBB2
Hydrochloric Acid SCHEMBL4373085 0.88 SRC (0.72) RETSRCEGFRKDRERBB2
SCHEMBL4379923 0.86 KDR (0.71) RETEGFRKDRERBB2EPHB4
Hydrochloric Acid SCHEMBL4380718 0.86 RET (0.73) RETEGFRKDRERBB2FLT4
SCHEMBL4383740 0.86 RET (0.75) RETSRCEGFRKDRERBB2
SCHEMBL4377794 0.85 RET (0.63) RETSRCEGFRKDRERBB2
SCHEMBL4232649 0.85 ERBB2 (0.59) RETSRCEGFRKDRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 RET 1047/4885SRC 1276/4885EGFR 549/4885

“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.