SCHEMBL229526

SCHEMBL229526

CC(=O)N1CCN(c2ccc(Nc3ncc4cc(-c5c(C)cccc5C)ccc4n3)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 2/20 0.59
SYK P43405 12/20 0.57
WEE1 P30291 1/20 0.56
EGFR P00533 4/20 0.53
CDK4 P11802 1/20 0.51
CCND1 P24385 1/20 0.51
CCND2 P30279 1/20 0.51
CCND3 P30281 1/20 0.51

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
SCHEMBL230101 0.89 BRAF (0.50) ALKSYK
SCHEMBL5501445 0.88 MAP4K1 (0.64) ALKWEE1EGFRCDK4CCND1
SCHEMBL226380 0.85 STK17A (0.58) WEE1CDK4CCND1CCND2CCND3
SCHEMBL29372589 0.82 ALK (0.67) ALKSYKWEE1EGFRCDK4
SCHEMBL29575961 0.79 ALK (0.64) ALKSYKWEE1EGFRCDK4
SCHEMBL2573809 0.79 YES1 (0.53)
SCHEMBL2573807 0.79 SRC (0.53) WEE1
SCHEMBL16513440 0.76 EGFR (0.79) SYKEGFR
SCHEMBL29847452 0.76 EGFR (0.79) SYKEGFR
SCHEMBL5497607 0.76 LCK (0.61)

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-8389530-B2 Substituted quinazoline compounds FOVEA PHARMACEUTICALS (FR) 2013-03-05 US claimed
US-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS FOVEA PHARMACEUTICALS SA 2012-01-05 US claimed
US-8389530-B2 Substituted quinazoline compounds FOVEA PHARMACEUTICALS (FR) 2013-03-05 US disclosed
US-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS FOVEA PHARMACEUTICALS SA 2012-01-05 US 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-20120004210-A1 SUBSTITUTED QUINAZOLINE COMPOUNDS MAP3K5, MAP3K1, MAP3K2 ALK 2550/4885SYK 1282/4885WEE1 625/4885

“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.