SCHEMBL6864932

SCHEMBL6864932

CC(C)COc1ccc2c(=O)c3ccccc3sc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 3/20 0.54
MAPT P10636 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 1/20 0.54
CDK1 P06493 1/20 0.43
MAPKAPK2 P49137 1/20 0.43
LMNA P02545 2/20 0.40
POLB P06746 2/20 0.40
TRIM24 O15164 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
HCRTR1 O43613 1/20 0.39
CSF1R P07333 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MC4R P32245 1/20 0.39
PAX8 Q06710 1/20 0.39

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
SCHEMBL23954356 0.92 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL4484085 0.84 MAPT (0.57) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13367156 0.83 ELANE (0.39) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338885 0.82 MAOB (0.39) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338845 0.82 KDM4E (0.55) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338844 0.82 KDM4E (0.55) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338875 0.81 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338856 0.81 MAPT (0.57) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13066291 0.81 MAPT (0.62) ALDH1A1KDM4EMAPTL3MBTL1TDP1
SCHEMBL13338865 0.81 KDM4E (0.57) ALDH1A1KDM4EMAPTL3MBTL1TDP1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2192163-B1 Ink composition and inkjet recording method FUJIFILM CORP (JP) 2017-04-19 EP disclosed
US-8557889-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-10-15 US disclosed
US-8557889-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-10-15 US disclosed
EP-2192163-A1 Ink composition and inkjet recording method Fujifilm Corporation (JP) 2010-06-02 EP disclosed
US-20100129565-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-05-27 US disclosed
US-20100129565-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-05-27 US disclosed
EP-1438307-A2 DERIVATIVES OF 4-(THIO- OR SELENOXANTHENE-9-YLIDENE)-PIPERIDINE OR ACRIDINE AND ITS USE AS A SELECTIVE 5-HT2B RECEPTOR ANTAGONIST Biofrontera Pharmaceuticals GmbH (DE) 2004-07-21 EP disclosed
WO-2003035646-A2 DERIVATIVES OF 4-(THIO- OR SELENOXANTHENE-9-YLIDENE)-PIPERIDINE OR ACRIDINE AND ITS USE AS A SELECTIVE 5-HT2B RECEPTOR ANTAGONIST BIOFRONTERA PHARMACEUTICALS GMBH (DE) 2003-05-01 WO disclosed