SCHEMBL8029787

SCHEMBL8029787

CCCCC1(CC)CSc2ccc(Br)cc2NC1=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.32
AHR P35869 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
SLC10A2 Q12908 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
SCHEMBL8028186 0.82 KDM4E (0.36) TP53MAPT
SCHEMBL29383802 0.80 PTPN1 (0.38)
SCHEMBL8031445 0.80 PTPN1 (0.38)
SCHEMBL6843532 0.80 GHSR (0.36) MAPT
SCHEMBL8024372 0.77 MAOB (0.50) LMNAMAPTSLC10A2
SCHEMBL21586026 0.75 SLC10A2 (0.31) SLC10A2
SCHEMBL21585955 0.75 LMNA (0.34) LMNAMAPT
SCHEMBL29381681 0.75 PTPN1 (0.39)
SCHEMBL22286617 0.72 PTPN1 (0.34)
SCHEMBL29728473 0.72 PTPN1 (0.34)

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
EP-0792268-B1 HYPOLIPIDEMIC BENZOTHIAZEPINES WELLCOME FOUND (GB) 2000-02-23 EP disclosed
US-5998400-A Hypolipidemic benzothiazepines GLAXO WELLCOME INC. (US) 1999-12-07 US disclosed
WO-1996016051-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1996-05-30 WO disclosed