SCHEMBL9338997

SCHEMBL9338997

COC(=O)c1ccc(OCCCN(CCOCc2ccccc2)c2ccc(Cl)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NOX1 Q9Y5S8 1/20 0.42
NR4A2 P43354 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
PLA2G4A P47712 1/20 0.41
ADAMTS4 O75173 1/20 0.41
ADAMTS5 Q9UNA0 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
LTA4H P09960 1/20 0.40

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
SCHEMBL9335600 0.90 NR4A2 (0.53) RAB9ANPC1MEN1KMT2ANR4A2
SCHEMBL9339202 0.84 MAPT (0.52) MAPTRAB9ANPC1KDM4ETDP1
SCHEMBL9339040 0.82 MAPT (0.55) MAPTRAB9ANPC1KDM4ETDP1
Hydrochloric Acid SCHEMBL9339518 0.81 RAB9A (0.53) MAPTRAB9ANPC1TDP1L3MBTL1
SCHEMBL6020046 0.80 MAPT (0.68) MAPTRAB9ANPC1KDM4ETDP1
SCHEMBL25686475 0.79 MAPT (0.75) MAPTRAB9ANPC1KDM4ETDP1
SCHEMBL9339039 0.79 MAPT (0.51) MAPTRAB9ANPC1KDM4ETDP1
SCHEMBL9337508 0.78 MAPT (0.57) MAPTRAB9ANPC1KDM4EL3MBTL1
SCHEMBL9337596 0.78 MAPT (0.50) MAPTRAB9ANPC1KDM4ETDP1
SCHEMBL9335742 0.78 MAPT (0.50) MAPTRAB9ANPC1KDM4ETDP1

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