SCHEMBL2604845

SCHEMBL2604845

CC(C)c1nc2ccccc2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccc(-c4ccccc4)cc3)c3ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.43
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
PDE10A Q9Y233 3/20 0.38
CYP1A2 P05177 2/20 0.38
CNR2 P34972 1/20 0.37
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2604827 0.99 CRBN (0.43) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2604828 0.93 CRBN (0.47) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2604846 0.93 CRBN (0.47) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24674275 0.87 CRBN (0.46) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2604826 0.87 CNR2 (0.45) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24674134 0.87 CRBN (0.46) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24673723 0.87 CRBN (0.46) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2604844 0.87 CNR2 (0.45) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20152539 0.85 CRBN (0.53) CRBNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2604834 0.85 MAPK1 (0.57) ESR1ESR2MAPK1HTTLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed