SCHEMBL15025909

SCHEMBL15025909

Cc1ccc(-c2nc(-c3ccc(-c4ccc(C)c(C)c4)c(C)c3)cc(-c3ccc(-c4ccc(C)c(C)c4)c(C)c3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.44
NPC1 O15118 3/20 0.44
ADORA1 P30542 2/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CTSK P43235 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
AGTR1 P30556 1/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP1B1 Q16678 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
SCHEMBL15026012 0.91 ADORA3 (0.44) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL15025869 0.90 NPC1 (0.41) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL15025996 0.86 MEN1 (0.45) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL15025819 0.83 ADORA3 (0.46) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL15025700 0.82 NPC1 (0.50) ADORA3NPC1MEN1KMT2AMAPT
SCHEMBL15025908 0.81 ADORA3 (0.45) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL15025812 0.80 NPC1 (0.41) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL19750260 0.80 NPC1 (0.46) ADORA3NPC1ADORA1MEN1KMT2A
SCHEMBL26529413 0.78 ESR2 (0.47) NPC1MEN1KMT2AMAPTALDH1A1
SCHEMBL11976557 0.78 MEN1 (0.59) 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