SCHEMBL9974948

SCHEMBL9974948

Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(C)cc5)cc4)c(-c4ccc(-c5ccncc5)cc4)cc3-c3ccc(-c4ccncc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
GCGR P47871 2/20 0.50
MAPK14 Q16539 2/20 0.50
KDR P35968 1/20 0.50
KDM4E B2RXH2 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 3/20 0.47
PDE3B Q13370 2/20 0.46
PDE3A Q14432 2/20 0.46
CYP46A1 Q9Y6A2 1/20 0.46
ALDH1A1 P00352 2/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
STAT1 P42224 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL9974936 0.88 MAPT (0.65) MAPTLMNAGCGRMAPK14SMN1; SMN2
SCHEMBL14655870 0.88 MAPT (0.65) MAPTLMNAGCGRMAPK14SMN1; SMN2
SCHEMBL94519 0.88 MAPT (0.65) MAPTLMNAGCGRMAPK14KDR
SCHEMBL11988032 0.88 MAPT (0.65) MAPTLMNAGCGRMAPK14KDR
SCHEMBL13019480 0.88 MAPT (0.65) MAPTLMNAGCGRMAPK14KDR
SCHEMBL13728525 0.83 MAPK14 (0.57) MAPTLMNAGCGRMAPK14KDR
SCHEMBL15389180 0.83 MAPT (0.62) MAPTLMNAGCGRMAPK14KDM4E
SCHEMBL17006477 0.83 ACHE (0.53) MAPTLMNAKDM4EKMT2ANPC1
SCHEMBL3422005 0.82 CYP46A1 (0.54) MAPTLMNAGCGRMAPK14KDM4E
SCHEMBL25871395 0.82 CYP46A1 (0.54) MAPTLMNAGCGRMAPK14KDM4E

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
WO-2012081541-A1 1, 2, 4, 5-SUBSTITUTED PHENYL DERIVATIVE, PRODUCTION METHOD FOR SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 (JP) 2012-06-21 WO disclosed