SCHEMBL7650185

SCHEMBL7650185

ICCOCCOCCOc1cc[c]cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
APP P05067 10/20 0.34
RECQL P46063 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KCNA3 P22001 1/20 0.32
RARB P10826 1/20 0.32

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
SCHEMBL10785918 0.82 KCNA3 (0.43) KDM4EMAPK1TDP1RECQLMAPT
SCHEMBL27448379 0.81 KCNA3 (0.41) RECQLL3MBTL1KCNA3
SCHEMBL7648797 0.80 SMN1; SMN2 (0.51) KDM4EMAPK1TDP1APPRECQL
SCHEMBL2457210 0.80 KDM4E (0.45) KDM4EMAPK1TDP1APPRECQL
SCHEMBL3167260 0.80 KDM4E (0.49) KDM4EMAPK1TDP1APPRECQL
SCHEMBL17627814 0.80 APP (0.53) KDM4EMAPK1TDP1APPRECQL
SCHEMBL7928494 0.80 LMNA (0.41) KDM4EMAPK1TDP1APPRECQL
SCHEMBL7654202 0.80 KDM4E (0.37) KDM4EMAPK1TDP1APPRECQL
SCHEMBL4981575 0.80 APP (0.53) KDM4EMAPK1TDP1APPRECQL
SCHEMBL28556579 0.80 KDM4E (0.49) KDM4EMAPK1TDP1APPRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002536440-A 2002-10-29 JP claimed
EP-1155007-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. Searle LLC (US) 2001-11-21 EP claimed
WO-2000047568-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. SEARLE LLC (US) 2000-08-17 WO claimed
EP-1155007-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. Searle LLC (US) 2001-11-21 EP disclosed
WO-2000047568-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. SEARLE LLC (US) 2000-08-17 WO disclosed