SCHEMBL15945853

SCHEMBL15945853

Cc1cccc(-c2ccc3c4cccc5c(-c6cccc(C)n6)ccc(c6cccc2c63)c54)n1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.56
CCR8 P51685 1/20 0.56
CYP2A6 P11509 1/20 0.41
METAP2 P50579 1/20 0.41
HSP90AA1 P07900 1/20 0.38
TGFBR1 P36897 14/20 0.38
MAPK14 Q16539 4/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38

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
SCHEMBL11954036 0.85 CCR1 (0.52) CCR1CCR8CYP2A6METAP2TGFBR1
SCHEMBL15197357 0.82 CCR1 (0.58) CCR1CCR8CYP2A6METAP2TGFBR1
SCHEMBL19937031 0.79 CCR1 (0.44) CCR1CCR8CYP2A6METAP2HSP90AA1
SCHEMBL12270088 0.78 CCR1 (0.58) CCR1CCR8CYP2A6METAP2TGFBR1
SCHEMBL15890931 0.74 CCR1 (0.62) CCR1CCR8CYP2A6METAP2TGFBR1
SCHEMBL29388304 0.73 CCR1 (1.00) CCR1CCR8CYP2A6METAP2HSP90AA1
SCHEMBL30511194 0.73 CCR1 (1.00) CCR1CCR8CYP2A6METAP2HSP90AA1
SCHEMBL196966 0.73 CCR1 (1.00) CCR1CCR8CYP2A6METAP2HSP90AA1
SCHEMBL6609571 0.73 ALDH1A1 (0.58) CCR1CCR8TGFBR1
SCHEMBL12270041 0.72 TGFBR1 (0.67) CCR1CCR8TGFBR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11177450-B2 Organoelectroluminescent element, and light emission device, display device, and illumination device in which said organoelectroluminescent element is used UDC IRELAND LIMITED (IE) 2021-11-16 US disclosed
US-20140225085-A1 Organoelectroluminescent Element, and Light Emission Device, Display Device, and Illumination Device in which Said Organoelectroluminescent Element is Used UDC IRELAND LIMITED (IE) 2014-08-14 US disclosed
US-20140225085-A1 Organoelectroluminescent Element, and Light Emission Device, Display Device, and Illumination Device in which Said Organoelectroluminescent Element is Used UDC IRELAND LIMITED (IE) 2014-08-14 US disclosed