SCHEMBL8701443

SCHEMBL8701443

COc1ccc(OC)c(CC(=O)c2ccc(C(C)C)[c]c2C(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HTR2A P28223 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
PKM P14618 1/20 0.40
TP53 P04637 1/20 0.40
TTR P02766 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
MAPT P10636 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
SCHEMBL7212819 0.84 TTR (0.53) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL7207810 0.83 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2LMNAHTTMEN1
SCHEMBL8701445 0.81 HSD17B10 (0.56) HSD17B10ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL3924851 0.76 HSD17B10 (0.63) HSD17B10ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL3923921 0.75 HSD17B10 (0.61) HSD17B10ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14519837 0.72 HSD17B10 (0.71) HSD17B10MEN1KMT2AHTR2AMTNR1A
SCHEMBL11812619 0.72 HSD17B10 (0.61) HSD17B10ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL3922719 0.71 HSD17B10 (0.69) HSD17B10ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL7206388 0.71 TSHR (0.41) ALDH1A1SMN1; SMN2LMNAHTTMEN1
SCHEMBL7206345 0.70 GABRA1 (0.41) SMN1; SMN2LMNAMEN1KMT2A

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-0841913-A1 USE OF SULFAMIC ACID DERIVATIVES, ACYL SULFONAMIDES OR SULFONYL CARBAMATES FOR THE MANUFACTURE OF A MEDICAMENT FOR LOWERING LIPOPROTEIN LEVELS WARNER-LAMBERT COMPANY (US) 1998-05-20 EP disclosed
US-5633287-A N-acyl sulfamic acid esters (or thioesters), N-acyl sulfonamides, and n-sulfonyl carbamic acid esters (or thioesters) as hypercholesterolemic agents WARNER-LAMBERT COMPANY (US) 1997-05-27 US disclosed
WO-1997005868-A1 USE OF SULFAMIC ACID DERIVATIVES, ACYL SULFONAMIDES OR SULFONYL CARBAMATES FOR THE MANUFACTURE OF A MEDICAMENT FOR LOWERING LIPOPROTEIN LEVELS WARNER-LAMBERT COMPANY (US) 1997-02-20 WO disclosed