SCHEMBL7643321

SCHEMBL7643321

Cc1ccc(Nc2ccccc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 8/20 0.54
▸ P2RY4 P51582 9/20 0.52
▸ P2RY2 P41231 7/20 0.52
▸ P2RY6 Q15077 4/20 0.52
▸ P2RY1 P47900 3/20 0.52
▸ CDK2 P24941 2/20 0.52
▸ MAPK1 P28482 4/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ MAPT P10636 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ TSHR P16473 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ CYP3A4 P08684 1/20 0.47

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
SCHEMBL25950758 0.91 PTPRA (0.46) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL14403208 0.91 P2RY12 (0.50) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL595104 0.89 P2RY12 (0.56) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL14600814 0.88 P2RY12 (0.55) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL21817605 0.87 P2RY2 (0.58) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL14255728 0.86 P2RY4 (0.61) P2RY12P2RY4P2RY2P2RY6MAPK1
SCHEMBL11605977 0.86 P2RY12 (0.57) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL30922379 0.85 MAPT (0.59) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL31150807 0.85 MAPT (0.59) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL139752 0.85 MAPT (0.59) P2RY12P2RY4P2RY2P2RY6P2RY1

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-7901496-B2 Phase change inks XEROX CORPORATION (US) 2011-03-08 — — US disclosed
US-7683192-B2 Colorant compounds XEROX CORPORATION (US) 2010-03-23 — — US disclosed
US-7622580-B2 Colorant compounds XEROX CORPORATION (US) 2009-11-24 — — US disclosed
US-7211131-B2 Phase change inks XEROX CORPORATION (US) 2007-05-01 — — US disclosed
EP-1196466-A1 POLYMERIZABLE COMPOSITION OF ALIPHATIC POLYOL (ALLYL CARBONATE) PPG Industries Ohio, Inc. (US) 2002-04-17 — — EP disclosed
WO-2000078832-A1 POLYMERIZABLE COMPOSITION OF ALIPHATIC POLYOL (ALLYL CARBONATE) PPG INDUSTRIES OHIO, INC. (US) 2000-12-28 — — WO disclosed
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