SCHEMBL14020113

SCHEMBL14020113

O=C1c2ccccc2C(=O)c2cc3c(=O)c4ccccc4sc3cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
MAPT P10636 8/20 0.51
ALDH1A1 P00352 7/20 0.51
RAB9A P51151 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
NPC1 O15118 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
POLB P06746 4/20 0.49
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
GPR3 P46089 1/20 0.43
HCRTR1 O43613 2/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
CDC25B P30305 1/20 0.41
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
HPGD P15428 3/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL2335645 0.89 ALDH1A1 (0.59) KDM4EMAPTALDH1A1RAB9AL3MBTL1
Anthraquinone SCHEMBL3693137 0.89 KDM4E (0.56) KDM4EMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL8595006 0.87 KDM4E (0.55) KDM4EMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL10057989 0.85 MAPT (0.63) KDM4EMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL5019890 0.83 KDM4E (0.69) KDM4EMAPTALDH1A1RAB9AL3MBTL1
Anthraquinone SCHEMBL28214347 0.82 KDM4E (0.84) KDM4EMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL21666727 0.81 KDM4E (0.67) KDM4EMAPTALDH1A1RAB9AL3MBTL1
SCHEMBL28134706 0.81 ELANE (0.64) KDM4EMAPTALDH1A1RAB9AL3MBTL1
Anthraquinone SCHEMBL28295561 0.80 KDM4E (0.53) KDM4EMAPTALDH1A1RAB9AL3MBTL1
Dibenzothiophene SCHEMBL28650870 0.79 GPR3 (0.64) KDM4EMAPTALDH1A1RAB9AL3MBTL1

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-1688466-B1 Ink composition, ink jet recording method, printed material, method of producing planographic printing plate, and planographic printing plate FUJIFILM CORP (JP) 2008-11-26 EP disclosed