SCHEMBL11606520

SCHEMBL11606520

O=C1c2ccccc2C(=O)c2c(Nc3ccc(Cc4ccccc4)cc3)ccc(Nc3ccccc3)c21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 7/20 0.60
▸ P2RY4 P51582 5/20 0.60
▸ NPC1 O15118 3/20 0.59
▸ RAB9A P51151 3/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ LMNA P02545 3/20 0.59
▸ MAPK1 P28482 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ MAPT P10636 2/20 0.59
▸ NPSR1 Q6W5P4 2/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ CYP1A2 P05177 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ P2RY2 P41231 3/20 0.47
▸ CDK2 P24941 2/20 0.47
▸ P2RY1 P47900 2/20 0.47
▸ P2RY6 Q15077 2/20 0.47
▸ PRKCA P17252 1/20 0.46
▸ MTOR P42345 1/20 0.44

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
SCHEMBL11605189 0.88 MAPT (0.55) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL11605977 0.87 P2RY12 (0.57) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL13717469 0.87 P2RY12 (0.57) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL595104 0.87 P2RY12 (0.56) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL11814555 0.85 LMNA (0.60) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL14600814 0.85 P2RY12 (0.55) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL11602052 0.83 P2RY4 (0.50) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL3975751 0.83 P2RY4 (0.62) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL30922379 0.82 MAPT (0.59) P2RY12P2RY4NPC1RAB9AMEN1
SCHEMBL31150807 0.82 MAPT (0.59) P2RY12P2RY4NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4128396-A Process for the improvement of dyeing properties of pigments of the anilino and arylmercapto anthraquinone series CIBA-GEIGY CORPORATION (US) 1978-12-05 — — US disclosed
US-3975410-A Process for the manufacture of halogen-containing anthraquinoidal compounds, their use and new halogen-containing anthraquinoidal compounds CIBA-GEIGY CORPORATION (US) 1976-08-17 — — US disclosed
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