SCHEMBL14596392

SCHEMBL14596392

CN(C)CCCNc1nc(CN(C)S(=O)(=O)c2cccc3ccccc23)nc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
MAPK1 P28482 1/20 0.52
FLT3 P36888 9/20 0.50
RAD52 P43351 4/20 0.49
POLB P06746 3/20 0.48
KMT2A Q03164 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
TOP2A P11388 2/20 0.48
NPC1 O15118 1/20 0.47
SLC2A1 P11166 1/20 0.47
APOBEC3A P31941 1/20 0.47
RAB9A P51151 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
KDM1A O60341 1/20 0.44
EHMT2 Q96KQ7 1/20 0.44
RCOR1 Q9UKL0 1/20 0.44
NPY5R Q15761 1/20 0.43
PDE5A O76074 1/20 0.43

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
SCHEMBL14596158 0.89 POLB (0.53) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596151 0.87 ALDH1A1 (0.48) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596168 0.87 ALDH1A1 (0.48) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596175 0.85 POLB (0.51) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596181 0.85 POLB (0.50) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596163 0.84 FLT3 (0.53) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596148 0.84 RAD52 (0.60) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596174 0.84 ALDH1A1 (0.57) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596176 0.84 FLT3 (0.65) ALDH1A1MAPK1FLT3RAD52POLB
SCHEMBL14596170 0.84 POLB (0.54) ALDH1A1MAPK1FLT3RAD52POLB

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 ALDH1A1 1994/4885MAPK1 2089/4885FLT3 191/4885

“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.