SCHEMBL8900334

SCHEMBL8900334

COC(=O)c1cc(OCc2ccc(-c3ccccc3)cc2)cc(C(=O)OC)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.60
LMNA P02545 2/20 0.59
HPGD P15428 1/20 0.59
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
RAB9A P51151 3/20 0.53
MAPT P10636 2/20 0.53
FFAR1 O14842 1/20 0.52
GSTP1 P09211 1/20 0.51
NPC1 O15118 2/20 0.51
NR4A2 P43354 2/20 0.50
BCL2L1 Q07817 1/20 0.50
MCL1 Q07820 1/20 0.50
MAOB P27338 1/20 0.50
EGFR P00533 1/20 0.49

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
SCHEMBL8663810 0.93 LMNA (0.59) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL183994 0.91 LMNA (0.70) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL731203 0.90 LMNA (0.62) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL391547 0.88 MEN1 (0.71) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL27395439 0.87 RAB9A (0.68) LMNAMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL3129603 0.87 MEN1 (0.74) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL8900859 0.85 MEN1 (0.76) SMPD1MEN1KMT2ASMN1; SMN2FFAR1
SCHEMBL14345811 0.84 LMNA (0.62) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL3592344 0.84 SMN1; SMN2 (0.62) SMPD1LMNAHPGDMEN1KMT2A
SCHEMBL29475634 0.84 LMNA (0.69) SMPD1LMNAHPGDMEN1KMT2A

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-0663391-B1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls HOFFMANN LA ROCHE (CH) 1997-04-09 EP disclosed
US-5521160-A COMPOUNDS FOR TREATMENT OF ATHERIOSCLEROSIS IN BLOOD VESSELS AND PREVENTION OF RESTENOSIS AFTER ANGIOPLASTY HOFFMANN-LA ROCHE INC. (US) 1996-05-28 US disclosed
EP-0663391-A1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls F. HOFFMANN-LA ROCHE AG (CH) 1995-07-19 EP disclosed