SCHEMBL10420481

SCHEMBL10420481

CSC(CCCCCc1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.49
PPARG P37231 5/20 0.49
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
KCNH2 Q12809 1/20 0.42
LTB4R Q15722 2/20 0.41
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.40
PLAAT3 P53816 1/20 0.40
PLAAT5 Q96KN8 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
SCHEMBL10418815 0.84 CYP2C9 (0.49) PPARAPPARGHDAC3HDAC4HDAC1
SCHEMBL9613997 0.82 PPARA (0.50) PPARAPPARGPLAAT3PLAAT5PLAAT2
SCHEMBL10419191 0.82 PPARG (0.47) PPARAPPARGHDAC3HDAC4HDAC1
SCHEMBL9614100 0.82 PPARA (0.50) PPARAPPARGPLAAT3PLAAT5PLAAT2
SCHEMBL10419188 0.81 PPARG (0.52) PPARAPPARGKCNH2HSD17B10
SCHEMBL9695329 0.81 PPARG (0.52) PPARAPPARGKCNH2HSD17B10
SCHEMBL9696793 0.81 PPARA (0.43) PPARAPPARGHDAC3HDAC4HDAC1
SCHEMBL11208077 0.81 PPARA (0.56) PPARAPPARGHDAC3HDAC4HDAC1
SCHEMBL9613992 0.80 PPARA (0.44) PPARAPPARGHSD17B10
SCHEMBL9614128 0.79 PPARG (0.43) PPARAPPARGPLAAT3PLAAT5PLAAT2

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-4933367-A Carboxylic acid derivatives, processes for the preparation thereof, the use thereof, and pharmaceutical compositions which contain these compounds BOEHRINGER MANNHEIM GMBH (DE) 1990-06-12 US disclosed