SCHEMBL4248517

SCHEMBL4248517

CSc1ccc(NC(NC(=O)O)NC(=O)O)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 6/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
PCSK9 Q8NBP7 1/20 0.37
NSD2 O96028 1/20 0.36
MAPT P10636 2/20 0.36
MITF O75030 1/20 0.36
GBA1 P04062 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4253082 0.73 TAS1R3 (0.35) MEN1KMT2AFDPSFDFT1
SCHEMBL30421111 0.72 PTK2 (0.59) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL4248528 0.69 HCAR3 (0.46) HCAR3MEN1ALDH1A1HTTKMT2A
SCHEMBL19151378 0.69 ADORA3 (0.53) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL4248518 0.69 KDM4E (0.43) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL19116862 0.69 SMN1; SMN2 (0.53) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL23845465 0.68 KDM4E (0.41) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL4248526 0.68 MEN1 (0.37) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL19125362 0.67 DEGS1 (0.55) MEN1ALDH1A1HTTKMT2AL3MBTL1
SCHEMBL19153944 0.67 SMN1; SMN2 (0.55) ALDH1A1L3MBTL1KDM4ELMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233928-A1 IMIDAZOLO-5-YL-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2009-09-17 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-20090233928-A1 IMIDAZOLO-5-YL-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION MKI67, TYMP, PCNA HCAR3 3813/4885MEN1 1784/4885ALDH1A1 466/4885

“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.