SCHEMBL13893952

SCHEMBL13893952

CCc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY4 P51582 5/20 0.57
▸ MAPT P10636 6/20 0.55
▸ NPC1 O15118 6/20 0.55
▸ RAB9A P51151 6/20 0.55
▸ LMNA P02545 5/20 0.55
▸ MAPK1 P28482 5/20 0.55
▸ L3MBTL1 Q9Y468 5/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ TDP1 Q9NUW8 2/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ APAF1 O14727 3/20 0.55
▸ MITF O75030 2/20 0.55
▸ P2RY2 P41231 2/20 0.52
▸ HTT P42858 3/20 0.49
▸ ALDH1A1 P00352 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ HPGD P15428 2/20 0.48

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
SCHEMBL3975751 0.94 P2RY4 (0.62) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL29352213 0.89 P2RY2 (0.60) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL35556 0.89 P2RY2 (0.60) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL375375 0.87 P2RY4 (0.50) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL21817605 0.86 P2RY2 (0.58) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL13893905 0.86 MEN1 (0.74) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL11540883 0.86 P2RY4 (0.61) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL21939350 0.86 MAPT (0.53) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL92477 0.84 P2RY2 (0.55) P2RY4MAPTNPC1RAB9ALMNA
SCHEMBL30513727 0.84 P2RY2 (0.55) P2RY4MAPTNPC1RAB9ALMNA

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-7513947-B2 Imparts color of blue, absorbs visible light with wavelength less than 700 mn and transmit a laser beam with wavelength at 800 nm to 1200 nm in infra-red region EI DU PONT DE NEMOURS AND COMPANY (US) 2009-04-07 — — US disclosed
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