SCHEMBL19257818

SCHEMBL19257818

CC(C)c1cc2ccccc2c2c1sc1ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
NQO1 P15559 1/20 0.38
NQO2 P16083 1/20 0.38
ALDH1A1 P00352 6/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
KDM4E B2RXH2 4/20 0.37
HPGD P15428 2/20 0.37
HCRTR1 O43613 2/20 0.37
HTT P42858 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
RAB9A P51151 3/20 0.37
GPR3 P46089 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
ATM Q13315 1/20 0.36
PRNP P04156 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 2/20 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
SCHEMBL23776249 0.87 MAPT (0.40) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL16283926 0.78 ALDH1A1 (0.46) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL25035538 0.75 CASR (0.35) MAPTTNKSTNKS2ALDH1A1MEN1
SCHEMBL4159164 0.75 TRPM4 (0.47) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL14951318 0.75 PTPN1 (0.46) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL17383050 0.75 NQO2 (0.44) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL16282347 0.74 MAPT (0.43) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL9950434 0.74 MAPT (0.42) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL10035419 0.74 ALDH1A1 (0.36) MAPTTNKSTNKS2NQO1NQO2
SCHEMBL25993677 0.74 GPR3 (0.40) MAPTTNKSTNKS2NQO2ALDH1A1

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-9735373-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-08-15 US disclosed