SCHEMBL9815538

SCHEMBL9815538

CCOC(=O)Oc1cc(OC)cc2sc3ccccc3c(=O)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAOA P21397 11/20 0.44
MAOB P27338 11/20 0.44
LMNA P02545 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL9815568 0.83 TYMS (0.47) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL9455912 0.82 MAPT (0.49) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL13226079 0.82 MAPT (0.60) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL9128843 0.77 MAPT (0.55) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL10669824 0.77 MAPT (0.60) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL10498726 0.76 MAOA (0.49) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL11167133 0.74 MAPT (0.53) MAPTALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL51833 0.73 GABRP (0.50) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL29501112 0.73 GABRP (0.50) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL10788212 0.72 NPC1 (0.53) MAPTALDH1A1NPC1RAB9AL3MBTL1

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-0277915-B1 PHOTOINITIATOR MIXTURE CONTAINING A TITANOCENE AND A 3-KETOCOUMARIN CIBA-GEIGY AG (CH) 1991-09-04 EP disclosed