SCHEMBL12462012

SCHEMBL12462012

COc1ccc(Nc2nc3c(OC)cccn3c(=O)c2CO)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 5/20 0.45
RXFP1 Q9HBX9 1/20 0.45
BCL6 P41182 3/20 0.43
SYK P43405 1/20 0.43
PIP4K2A P48426 3/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GRM4 Q14833 1/20 0.42
GAA P10253 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
FLT3 P36888 1/20 0.42
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL2216004 0.94 MAPT (0.40) TP53KMT2AMAPTRXFP1BCL6
SCHEMBL2219286 0.92 STK10 (0.46) TP53KMT2AMAPTRXFP1BCL6
SCHEMBL2218318 0.91 KDM4E (0.44) KMT2AMAPTBCL6SYKMEN1
SCHEMBL12462332 0.91 PNLIP (0.47) TP53KMT2AMAPTRXFP1SYK
SCHEMBL15887219 0.90 NPSR1 (0.43) TP53KMT2AMAPTRXFP1SYK
SCHEMBL2216144 0.90 NPSR1 (0.50) TP53KMT2AMAPTMEN1ALDH1A1
SCHEMBL2168136 0.89 BCL6 (0.39) TP53KMT2AMAPTRXFP1BCL6
SCHEMBL2218507 0.88 TNF (0.44) TP53KMT2AMAPTMEN1ALDH1A1
SCHEMBL12462326 0.87 NPSR1 (0.40) MAPTRXFP1BCL6SYKGRM4
SCHEMBL15887163 0.87 MAPT (0.41) TP53KMT2AMAPTRXFP1PIP4K2A

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-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES NO ZAESUNG (KR) 2013-01-10 US disclosed
US-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES NO ZAESUNG (KR) 2013-01-10 US disclosed
US-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES NO ZAESUNG (KR) 2013-01-10 US disclosed
WO-2011085990-A1 ANTI - INFECTIVE PYRIDO (1,2 -A) PYRIMIDINES INSTITUT PASTEUR KOREA (KR) 2011-07-21 WO 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-20130012506-A1 ANTI-INFECTIVE PYRIDO (1,2-A) PYRIMIDINES TYMS, TYMP, DCTPP1 TP53 1557/4885KMT2A 4390/4885MAPT 2115/4885

“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.