SCHEMBL6270802

SCHEMBL6270802

O=C(O)c1ccc(OCC2CC(=O)N(c3ccc(OS(=O)(=O)c4ccccc4)cc3)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
GLA P06280 1/20 0.42
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.39
GAA P10253 1/20 0.39
F2 P00734 1/20 0.39
ABL1 P00519 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
SCHEMBL6267665 0.91 CMA1 (0.48) ALDH1A1RAB9ANPC1TP53MEN1
SCHEMBL6270321 0.91 CTSG (0.46) ALDH1A1RAB9ANPC1TP53MEN1
SCHEMBL6265407 0.87 TP53 (0.48) ALDH1A1RAB9ATP53MEN1KMT2A
SCHEMBL6272688 0.87 ALDH1A1 (0.48) ALDH1A1RAB9ANPC1TP53MEN1
SCHEMBL6267079 0.87 ALDH1A1 (0.43) ALDH1A1TP53MEN1KMT2AUSP2
SCHEMBL6272753 0.86 ALDH1A1 (0.45) ALDH1A1TP53MEN1KMT2AUSP2
SCHEMBL6265056 0.85 ALDH1A1 (0.43) ALDH1A1TP53MEN1KMT2AUSP2
SCHEMBL6267136 0.83 NR4A1 (0.56) RAB9ANPC1TP53MEN1KMT2A
SCHEMBL6266719 0.83 ALDH1A1 (0.45) ALDH1A1RAB9ANPC1TP53MEN1
SCHEMBL6271800 0.83 GLA (0.46) ALDH1A1RAB9ANPC1TP53MEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000620-B1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBITORS TAIHO PHARMACEUTICAL CO LTD (JP) 2005-12-07 EP disclosed
US-6166036-A Lp(a)-lowering agent and apolipoprotein (a) formation suppressing agent TAIHO PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-1000620-A1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBTORS TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 2000-05-17 EP disclosed
EP-0393607-B1 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMA CO LTD (JP) 1996-02-21 EP disclosed
EP-0393607-A2 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 EP disclosed