SCHEMBL7220490

SCHEMBL7220490

Cc1oc(-c2ccc(N(C)C)cc2)nc1Cc1ccc(CC=CSCC(=O)O)o1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALDH1A1 P00352 2/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
LMNA P02545 2/20 0.36
PPARA Q07869 5/20 0.35
PPARG P37231 4/20 0.35
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL7220487 1.00 KDM4E (0.40) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6770927 0.82 POLB (0.45) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6776054 0.80 KDM4E (0.39) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6776046 0.80 KDM4E (0.39) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6780496 0.73 KDM4E (0.36) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL6780504 0.73 KDM4E (0.36) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL6771330 0.73 HSD17B10 (0.41) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6771328 0.73 HSD17B10 (0.41) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6776575 0.71 PPARA (0.37) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1
SCHEMBL6776581 0.71 PPARA (0.37) KDM4ESMN1; SMN2HPGDHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6589969-B1 A peroxisome proliferator activated receptor regulator containing a compound of formula (I) Because of having an effect of regulating PPAR, a compound of formula (I) is useful as a hypoglycemic agent, a hypolipidemic agent, a preventive ONO PHARMACEUTICAL CO., LTD. (JP) 2003-07-08 US claimed