SCHEMBL13760149

SCHEMBL13760149

CCc1ccc(-c2ccc(N(C)C)cc2)cc1CC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
PGR P06401 1/20 0.44
HDAC6 Q9UBN7 2/20 0.42
HDAC1 Q13547 1/20 0.42
PNPLA2 Q96AD5 1/20 0.41
PSMB5 P28074 1/20 0.41
AOC3 Q16853 2/20 0.41
CYP3A4 P08684 2/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40

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
SCHEMBL10304786 0.85 MAPT (0.42) MAPTSMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL12648767 0.85 MAPT (0.42) MAPTSMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL10916725 0.82 HSD17B1 (0.45) ALOX15HSD17B1
SCHEMBL13699893 0.81 ALDH1A1 (0.41) MAPTSMN1; SMN2ALDH1A1TSHRCYP3A4
SCHEMBL28992451 0.77 DCLRE1A (0.47) MAPTSMN1; SMN2ALDH1A1MEN1LMNA
SCHEMBL30380433 0.77 DCLRE1A (0.47) MAPTSMN1; SMN2ALDH1A1MEN1LMNA
SCHEMBL11547412 0.75 ALDH1A1 (0.79) MAPTSMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL124209 0.75 ALDH1A1 (0.79) MAPTSMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL1623876 0.74 ALDH1A1 (0.58) MAPTSMN1; SMN2ALDH1A1TSHRHSD17B10
SCHEMBL8079296 0.73 HSD17B1 (0.41) HSD17B1

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
EP-2085450-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-08-05 EP disclosed