SCHEMBL230427

SCHEMBL230427

Cc1cccc(C)c1-c1ccc2nc(Nc3ccc(OCC(=O)N4CCC(N(C)C)C4)cc3)ncc2c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.45
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
BRAF P15056 6/20 0.41
TDP1 Q9NUW8 1/20 0.41
MCHR1 Q99705 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
CDK1 P06493 2/20 0.40
CDK2 P24941 2/20 0.40
WEE1 P30291 2/20 0.40
JAK3 P52333 1/20 0.40
BTK Q06187 1/20 0.40
NTRK1 P04629 1/20 0.39
EGFR P00533 1/20 0.39
DGAT1 O75907 1/20 0.39
FGFR4 P22455 1/20 0.39

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
SCHEMBL230426 1.00 SRC (0.45) SRCALDH1A1L3MBTL1BRAFTDP1
SCHEMBL229387 0.85 BRAF (0.43) SRCBRAFJAK3BTKNTRK1
SCHEMBL229386 0.85 BRAF (0.43) SRCBRAFJAK3BTKNTRK1
SCHEMBL2578705 0.80 SRC (0.41) SRCBRAFWEE1DGAT1FGFR4
SCHEMBL230633 0.78 SRC (0.49) SRCBRAF
SCHEMBL230632 0.78 SRC (0.49) SRCBRAF
SCHEMBL226164 0.75 SRC (0.55) SRCBRAFWEE1EGFR
SCHEMBL226165 0.75 SRC (0.55) SRCBRAFWEE1EGFR
SCHEMBL230249 0.74 SRC (0.77) SRCBRAFEGFR
SCHEMBL5501154 0.72 SRC (0.69) SRCBRAFCDK2EGFR

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 SRC 1325/4885ALDH1A1 3495/4885L3MBTL1 2123/4885

“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.