SCHEMBL14596276

SCHEMBL14596276

CC(C(=O)NCc1nc(N[C@H](C(N)=O)C(C)C)c2ccccc2n1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.43
ERCC4 Q92889 1/20 0.43
ACHE P22303 3/20 0.42
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
BCHE P06276 1/20 0.38
CFD P00746 1/20 0.38
APP P05067 1/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
CCR4 P51679 2/20 0.37
CCNE2 O96020 2/20 0.36
CDK4 P11802 2/20 0.36
CCND1 P24385 2/20 0.36
CCNE1 P24864 2/20 0.36
CDK2 P24941 2/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL14595843 0.92 KMT2A (0.44) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL14595628 0.89 ERCC1 (0.42) ERCC1ERCC4ACHEKMT2AALDH1A1
SCHEMBL14595979 0.88 ACHE (0.46) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL14596335 0.87 ACHE (0.45) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL14595831 0.86 CYP3A4 (0.50) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL14595993 0.86 ACHE (0.40) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL13159048 0.86 CASR (0.42) ACHEKMT2AALDH1A1MAPTMEN1
SCHEMBL14595957 0.86 CASR (0.42) ACHEKMT2AALDH1A1MAPTMEN1
SCHEMBL14595952 0.85 ACHE (0.51) ACHEKMT2AALDH1A1BCHECFD
SCHEMBL14595833 0.85 POLB (0.47) ACHEKMT2AALDH1A1CFDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070015774-A1 Quinazoline derivatives useful in cancer treatment SCHERING CORPORATION 2007-01-18 US disclosed
US-20070015774-A1 Quinazoline derivatives useful in cancer treatment SCHERING CORPORATION 2007-01-18 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-20070015774-A1 Quinazoline derivatives useful in cancer treatment TP53, TP53BP1, ACIN1 ERCC1 1877/4885ERCC4 714/4885ACHE 4163/4885

“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.