SCHEMBL15025992

SCHEMBL15025992

Cc1ccc(-c2nc(-c3cc(C)c(-c4ccc(C)cc4)c(C)c3)nc(-c3cc(C)c(-c4ccc(C)cc4)c(C)c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
ALDH1A1 P00352 2/20 0.38
ATM Q13315 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
MAPK1 P28482 1/20 0.38
ADORA1 P30542 2/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
PTBP1 P26599 1/20 0.38
CYP2C19 P33261 1/20 0.38
TNFSF10 P50591 1/20 0.38
MEN1 O00255 4/20 0.37

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
SCHEMBL15025688 0.92 ADORA3 (0.40) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL15025689 0.90 NPC1 (0.41) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL12622364 0.90 PDGFRB (0.40) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL15025871 0.88 ADORA3 (0.45) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL12622296 0.87 L3MBTL1 (0.41) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL18407768 0.86 AHR (0.41) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL15281176 0.85 ADORA3 (0.45) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL16769403 0.85 NPC1 (0.44) ADORA3NPC1RAB9AALDH1A1NPSR1
SCHEMBL12621116 0.83 ADORA3 (0.40) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1
SCHEMBL15025703 0.82 ADORA3 (0.47) ADORA3L3MBTL1CYP1A2CYP1A1CYP1B1

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