SCHEMBL10149290

SCHEMBL10149290

CCc1cc(-c2ccc(-c3nnc4c5ccccc5c5ccccc5n34)cc2)c2sc3ccc(C)cc3c2c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
TP53 P04637 4/20 0.33
RXFP1 Q9HBX9 2/20 0.33
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.31
MAOA P21397 1/20 0.31
PDE2A O00408 1/20 0.31

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
SCHEMBL10127356 0.94 POLB (0.42) POLBMAPTALDH1A1KDM4ETP53
SCHEMBL10127344 0.91 POLB (0.44) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL10127358 0.87 POLB (0.41) POLBMAPTALDH1A1TP53PDE2A
SCHEMBL10127413 0.85 POLB (0.43) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL10127367 0.85 POLB (0.40) POLBMAPTALDH1A1TP53
SCHEMBL10127369 0.84 POLB (0.40) POLBMAPTALDH1A1TP53MAOA
SCHEMBL10127388 0.81 POLB (0.47) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL10127377 0.81 POLB (0.47) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL10127408 0.81 POLB (0.41) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL10127371 0.81 POLB (0.39) POLBMAPTTP53RXFP1

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-2012017842-A1 TRIAZOLE DERIVATIVE, HETEROCYCLIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-02-09 WO disclosed