SCHEMBL19035336

SCHEMBL19035336

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

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR2 P34972 6/20 0.40
CNR1 P21554 4/20 0.40
THRB P10828 1/20 0.40
ADRA2A P08913 1/20 0.38
ABL1 P00519 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TLR8 Q9NR97 1/20 0.35
GAA P10253 1/20 0.34
ALOX12 P18054 1/20 0.34
CRHR1 P34998 1/20 0.34
NR4A2 P43354 1/20 0.33

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
SCHEMBL19035330 0.88 ADRA2A (0.39) MAPTALDH1A1TDP1L3MBTL1ADRA2A
SCHEMBL27893457 0.83 THRB (0.53) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL8958338 0.77 THRB (0.52) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL5605010 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL20565124 0.76 ADRA2A (0.42) MAPTALDH1A1TDP1L3MBTL1ADRA2A
SCHEMBL27893435 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL7998280 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL10381587 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL27482575 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB
SCHEMBL27520329 0.76 ADRA2A (0.50) MAPTALDH1A1TDP1L3MBTL1THRB

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