SCHEMBL9339129

SCHEMBL9339129

CCC(CNc1ccc(Cl)cc1)COc1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.49
MAPT P10636 2/20 0.47
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
PLA2G4B P0C869 1/20 0.43
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
TSHR P16473 2/20 0.41
LTA4H P09960 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL9339195 0.90 RAB9A (0.50) MAPTMEN1KMT2ATSHR
SCHEMBL9335724 0.85 NR4A2 (0.51) NR4A2MAPTMEN1KMT2AADRB2
SCHEMBL11546865 0.84 MAPT (0.61) NR4A2MAPTMEN1KMT2APLA2G4B
SCHEMBL11548347 0.84 MAPT (0.61) NR4A2MAPTMEN1KMT2APLA2G4B
SCHEMBL11446135 0.77 KMT2A (0.54) NR4A2MAPTMEN1KMT2AADRB2
SCHEMBL9335986 0.75 RAB9A (0.52) MAPTMEN1KMT2ATSHR
SCHEMBL10950578 0.75 MAPT (0.61) MAPTMEN1KMT2ATSHRMAPK1
SCHEMBL9337320 0.75 NR4A2 (0.51) NR4A2MEN1KMT2APLA2G4BTSHR
SCHEMBL14724729 0.74 PLA2G4B (0.56) PLA2G4BTSHRMAPK1TP53
SCHEMBL11546333 0.74 CYP1A2 (0.65) NR4A2MAPTMEN1KMT2APLA2G4B

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