SCHEMBL5397707

SCHEMBL5397707

CCOC(=O)C(C)(C)Oc1ccc(CN(C)Cc2cc(-c3ccc(C(F)(F)F)cc3)nn2Cc2ccccc2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.45
PPARD Q03181 9/20 0.45
PPARG P37231 9/20 0.45
SMN1; SMN2 Q16637 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.41
GPR119 Q8TDV5 4/20 0.40
MAPT P10636 1/20 0.40
HDAC3 O15379 2/20 0.38
HDAC4 P56524 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC7 Q8WUI4 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC10 Q969S8 2/20 0.38
HDAC11 Q96DB2 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC9 Q9UKV0 2/20 0.38
HDAC5 Q9UQL6 2/20 0.38
NCOR2 Q9Y618 2/20 0.38

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
SCHEMBL14446026 0.92 PPARA (0.54) PPARAPPARDPPARGHDAC3HDAC4
SCHEMBL4682592 0.91 PPARA (0.41) PPARAPPARDPPARGPOLBGPR119
SCHEMBL5418507 0.89 MAPT (0.45) PPARAPPARDPPARGSMN1; SMN2TDP1
SCHEMBL14445976 0.89 PPARA (0.41) PPARAPPARDPPARGGPR119MAPT
SCHEMBL4742857 0.86 MAPT (0.42) PPARAPPARDPPARGPOLBMAPT
SCHEMBL14445996 0.84 PPARA (0.50) PPARAPPARDPPARG
SCHEMBL4682098 0.82 PPARG (0.43) PPARAPPARDPPARGSMN1; SMN2TDP1
SCHEMBL4679107 0.82 PPARD (0.40) PPARAPPARDPPARGSMN1; SMN2TDP1
SCHEMBL14445993 0.82 PPARG (0.43) PPARAPPARDPPARGSMN1; SMN2TDP1
SCHEMBL4679104 0.81 PPARG (0.43) PPARAPPARDPPARGSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US claimed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed