SCHEMBL7652933

SCHEMBL7652933

OCCOCCOCON1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 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
SCHEMBL7654929 0.81 MEN1 (0.44) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL9556920 0.80
Triethylene Glycol SCHEMBL15413179 0.77 MEN1 (0.69) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL6049111 0.76 MEN1 (0.39) MEN1KMT2ATSHRMAPK1
Di(Hydroxyethyl)Ether SCHEMBL11145760 0.74 TSHR (0.67) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL1276025 0.73 KDM4E (0.48) MEN1KMT2ATSHRMAPK1
SCHEMBL10526522 0.73 KDM4E (0.48) MEN1KMT2ATSHRMAPK1
SCHEMBL10526359 0.73 KDM4E (0.48) MEN1KMT2ATSHRMAPK1
SCHEMBL28657416 0.72
Di(Hydroxyethyl)Ether SCHEMBL6153065 0.72 TSHR (0.62) MEN1KMT2ATSHRMAPK1THRB

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 3 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