SCHEMBL1099480

SCHEMBL1099480

COc1cccc(NC(=O)N2C=CC(=O)CC2c2ccc(F)cc2)c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.65
GRIN2B Q13224 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HTT P42858 1/20 0.48
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 3/20 0.47
HTR7 P34969 1/20 0.47
TSHR P16473 2/20 0.46
MGLL Q99685 1/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL1099077 0.89 P2RX7 (0.66) P2RX7ALDH1A1LMNAMAPTMEN1
SCHEMBL1099787 0.88 P2RX7 (0.62) P2RX7RAB9AALDH1A1MAPT
SCHEMBL1101227 0.86 P2RX7 (0.71) P2RX7MAPTKMT2A
SCHEMBL1100044 0.86 P2RX7 (0.74) P2RX7NPSR1HTTMAPTKMT2A
SCHEMBL1101191 0.85 P2RX7 (0.75) P2RX7NPSR1ALDH1A1TSHRLMNA
SCHEMBL1100504 0.85 P2RX7 (0.60) P2RX7GRIN2BALDH1A1
SCHEMBL1100485 0.84 P2RX7 (0.74) P2RX7TSHRMAPTMEN1GAA
SCHEMBL1100305 0.84 P2RX7 (0.74) P2RX7HTTALDH1A1TSHRMAPT
SCHEMBL1098580 0.84 P2RX7 (0.79) P2RX7NPSR1RAB9ANPC1ALDH1A1
SCHEMBL1099997 0.84 P2RX7 (0.77) P2RX7RAB9ANPC1HTR7MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153809-B2 Dihydropyridone ureas as P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-04-10 US disclosed
US-8153809-B2 Dihydropyridone ureas as P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-04-10 US disclosed
US-8153809-B2 Dihydropyridone ureas as P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-04-10 US disclosed
WO-2010072599-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2010-07-01 WO disclosed
US-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 US disclosed
US-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS P2RY1, P2RX1, P2RX3 P2RX7 5/4885GRIN2B 653/4885NPSR1 48/4885

“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.