SCHEMBL10275619

SCHEMBL10275619

COc1ccc(C2=CC(=O)N3N=C(C)C=CC(c4ccc(F)cc4F)=CC3N2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
RAB9A P51151 2/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AR P10275 1/20 0.34
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
HPGD P15428 1/20 0.32
APP P05067 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
SYK P43405 1/20 0.32
GSK3B P49841 1/20 0.32
AMY1A P0DUB6 1/20 0.32
METAP2 P50579 1/20 0.31
GRM2 Q14416 1/20 0.31

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
SCHEMBL10275614 1.00 KDM4E (0.34) KDM4ERAB9APKMALOX15CASP1
SCHEMBL10276615 0.89 PDE3B (0.32) ALOX5APFEN1GRM2
SCHEMBL10276613 0.89 PDE3B (0.32) ALOX5APFEN1GRM2
SCHEMBL10276189 0.87 APP (0.34) APPALOX5APFEN1GRM2
SCHEMBL10276187 0.87 APP (0.34) APPALOX5APFEN1GRM2
SCHEMBL10276214 0.86 PDE3B (0.35) ARALOX5APFEN1
SCHEMBL10275691 0.86 PDE3B (0.35) ARALOX5APFEN1
SCHEMBL10276618 0.85 KDM4E (0.35) KDM4ERAB9APKMALOX15CASP1
SCHEMBL10313543 0.84 MEN1 (0.33) KDM4EARMEN1ALDH1A1KMT2A
SCHEMBL10275520 0.81 MEN1 (0.34) MEN1KMT2AALOX5APFEN1

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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 US claimed

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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF TYMP, TYMS, ADORA3 KDM4E 3483/4885RAB9A 3784/4885PKM 2276/4885

“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.