SCHEMBL8028186

SCHEMBL8028186

CCCCC1(CC)CSc2ccccc2NC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
ELANE P08246 1/20 0.34
POLB P06746 1/20 0.34
MMP2 P08253 3/20 0.33
MMP9 P14780 3/20 0.33
MMP3 P08254 1/20 0.33
GAA P10253 4/20 0.33
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
TP53 P04637 1/20 0.32
HTR7 P34969 1/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 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
SCHEMBL8028203 0.89 ALDH1A1 (0.41) KDM4EHPGDALDH1A1BRD4CREBBP
SCHEMBL8024372 0.81 MAOB (0.50) KDM4EHPGDALDH1A1MMP2MMP9
SCHEMBL27453871 0.77 SIGMAR1 (0.33) ELANE
SCHEMBL6843532 0.76 GHSR (0.36) ALDH1A1MMP13HTR7MEN1MAPT
SCHEMBL5227372 0.75 MAOB (0.52) KDM4EHPGDALDH1A1MMP2MMP9
SCHEMBL8031445 0.74 PTPN1 (0.38) KDM4EALDH1A1KMT2A
SCHEMBL21585955 0.74 LMNA (0.34) ALDH1A1MAPTKMT2ANPSR1
SCHEMBL21586026 0.74 SLC10A2 (0.31) KMT2A
SCHEMBL8024749 0.73 ALDH1A1 (0.46) KDM4EHPGDALDH1A1BRD4CREBBP
SCHEMBL6310246 0.71 SLC10A2 (0.38) ELANEMAPT

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 4 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
EP-0792268-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1997-09-03 EP disclosed
WO-1996016051-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1996-05-30 WO disclosed