SCHEMBL6234420

SCHEMBL6234420

COc1ccc(C=O)cc1C(=O)N(C)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.53
TSHR P16473 1/20 0.53
AOX1 Q06278 1/20 0.53
HPGD P15428 3/20 0.49
TRIM24 O15164 1/20 0.49
ALDH5A1 P51649 1/20 0.49
ABAT P80404 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TRIM33 Q9UPN9 1/20 0.49
FDPS P14324 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
ABCG2 Q9UNQ0 1/20 0.44
PDE2A O00408 1/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 2/20 0.44
APP P05067 1/20 0.44
TTR P02766 1/20 0.43
CYP2C9 P11712 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL31055908 0.83 ALDH1A1 (0.50) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL8577030 0.81 ACHE (0.47) ALDH1A1TSHRSMN1; SMN2ABCG2MAPT
SCHEMBL31056340 0.81 APP (0.58) ALDH1A1HPGDSMN1; SMN2KDM4EAPP
SCHEMBL1013761 0.80 ALDH1A1 (0.41) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL4833864 0.80 MAPT (0.58) ALDH1A1TSHRHPGDSMN1; SMN2ABCG2
SCHEMBL2934800 0.79 ALDH1A1 (0.61) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL30362132 0.79 ALDH1A1 (0.61) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL1505421 0.79 ALDH1A1 (0.61) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL29956561 0.79 ALDH1A1 (0.61) ALDH1A1TSHRAOX1HPGDTRIM24
SCHEMBL5623892 0.78 TSHR (0.57) ALDH1A1TSHRMAPTNPSR1NPC1

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-1213287-B1 SUBSTITUTED BENZYLTHIAZOLIDINE-2,4-DIONE DERIVATIVES KYORIN SEIYAKU KK (JP) 2005-05-25 EP disclosed
US-6730687-B1 THERAPY OF METABOLIC DISEASES SUCH AS DIABETES AND HYPERLIPIDEMIA AS AGONISTS OF PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR KYORIN PHARMACEUTICAL CO., LTD. (JP) 2004-05-04 US disclosed
EP-1213287-A1 SUBSTITUTED BENZYLTHIAZOLIDINE-2,4-DIONE DERIVATIVES KYORIN PHARMACEUTICAL CO., LTD. (JP) 2002-06-12 EP disclosed