SCHEMBL15025908

SCHEMBL15025908

Cc1ccc(-c2nc(-c3cc(C)c(-c4ccc(C)c(C)c4)c(C)c3)cc(-c3cc(C)c(-c4ccc(C)c(C)c4)c(C)c3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.45
ADORA1 P30542 2/20 0.42
NPC1 O15118 2/20 0.41
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
MAPT P10636 4/20 0.41
HPGD P15428 4/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 1/20 0.40
AGTR1 P30556 1/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP1B1 Q16678 1/20 0.37
CTSK P43235 1/20 0.36
NTSR1 P30989 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL15025871 0.91 ADORA3 (0.45) ADORA3ADORA1MEN1KMT2AMAPT
SCHEMBL15025689 0.89 NPC1 (0.41) ADORA3ADORA1NPC1MEN1KMT2A
SCHEMBL15025703 0.82 ADORA3 (0.47) ADORA3ADORA1MEN1KMT2AMAPT
SCHEMBL15025909 0.81 ADORA3 (0.44) ADORA3ADORA1NPC1MEN1KMT2A
SCHEMBL19750260 0.81 NPC1 (0.46) ADORA3ADORA1NPC1MEN1KMT2A
SCHEMBL15025992 0.80 ADORA3 (0.40) ADORA3ADORA1NPC1MEN1KMT2A
SCHEMBL15025700 0.79 NPC1 (0.50) ADORA3NPC1MEN1KMT2AMAPT
SCHEMBL11976557 0.79 MEN1 (0.59) ADORA3ADORA1MEN1KMT2AMAPT
SCHEMBL12628206 0.77 MEN1 (0.57) ADORA3ADORA1MEN1KMT2AMAPT
SCHEMBL15025988 0.77 MEN1 (0.57) ADORA3ADORA1MEN1KMT2AMAPT

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-8981354-B2 Organic light-emitting polymer and device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-03-17 US disclosed
US-20130146852-A1 ORGANIC LIGHT-EMITTING POLYMER AND DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-06-13 US disclosed