SCHEMBL9337047

SCHEMBL9337047

O=C(CCN(CCCOc1ccc(C(=O)O)cc1)c1ccc(Cl)cc1)Nc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
LTA4H P09960 1/20 0.49
MAPK1 P28482 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
ALDH1A1 P00352 3/20 0.46
POLB P06746 2/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ATM Q13315 1/20 0.45
NR4A2 P43354 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL9337184 0.90 NR4A2 (0.50) MEN1KMT2ALTA4HMAPK1HRH3
SCHEMBL9337508 0.89 MAPT (0.57) MEN1KMT2AMAPK1HRH3ALDH1A1
SCHEMBL9335613 0.86 LTA4H (0.47) MEN1KMT2ALTA4HMAPK1HRH3
SCHEMBL9339374 0.83 NR4A2 (0.51) MAPK1HRH3ALDH1A1NR4A2L3MBTL1
SCHEMBL9335769 0.81 NR4A2 (0.51) MEN1KMT2AMAPK1HRH3ALDH1A1
SCHEMBL9339404 0.81 TP53 (0.52) MAPK1HRH3NR4A2HTT
SCHEMBL9335662 0.80 NR4A2 (0.57) MEN1KMT2ALTA4HALDH1A1NR4A2
SCHEMBL9339202 0.80 MAPT (0.52) LTA4HHRH3MAPTSMN1; SMN2L3MBTL1
SCHEMBL9337360 0.78 MAPK1 (0.56) MEN1KMT2AMAPK1HRH3NR4A2
SCHEMBL9339336 0.78 NR4A2 (0.48) MEN1KMT2AMAPK1HRH3ALDH1A1

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-0394440-B1 PHENYLCARBOXYLIC ACID DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1994-05-11 EP disclosed
US-4999378-A Antilipemic, anticholesterol, antidiabetic, treatment of atherosclerosis and obesity OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1991-03-12 US disclosed
EP-0394440-A1 PHENYLCARBOXYLIC ACID DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-31 EP disclosed