SCHEMBL19035330

SCHEMBL19035330

CCCCNc1cc(C)c(-c2cc(C)c(C)c(C)c2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.39
ALDH1A1 P00352 2/20 0.38
ABL1 P00519 1/20 0.37
TLR8 Q9NR97 4/20 0.36
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR4A2 P43354 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
CYP1A2 P05177 1/20 0.33
CRHR1 P34998 1/20 0.32
F2R P25116 2/20 0.31
AR P10275 1/20 0.31
ACHE P22303 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL19035336 0.88 MAPT (0.41) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL19035328 0.79 ALDH1A1 (0.41) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL20565124 0.77 ADRA2A (0.42) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL18830655 0.76 ADRA2A (0.41) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL27893457 0.72 THRB (0.53) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL10394666 0.72 ALDH1A1 (0.68) ALDH1A1ABL1MAPTTDP1L3MBTL1
SCHEMBL4495233 0.71 MAPT (0.47) ADRA2AALDH1A1TLR8MAPTTDP1
SCHEMBL26325046 0.70 ABL1 (0.43) ADRA2AALDH1A1ABL1TLR8MAPT
SCHEMBL3400985 0.69 ADRA2A (0.53) ADRA2AALDH1A1ABL1
SCHEMBL1485752 0.69 MAPT (0.70) ALDH1A1ABL1MAPTL3MBTL1CYP1A2

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-9691983-B2 Composition containing polymer compound and light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-27 US disclosed