SCHEMBL5762989

SCHEMBL5762989

CCOOC(=O)CCc1ccc(-c2cccc(N(C)C(=O)NCCc3ccccc3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.37
LMNA P02545 2/20 0.37
PLAAT5 Q96KN8 4/20 0.37
PLAAT4 Q9UL19 4/20 0.37
PLAAT3 P53816 3/20 0.37
PLAAT2 Q9NWW9 3/20 0.37
FFAR1 O14842 1/20 0.37
MAPT P10636 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
NCOR2 Q9Y618 1/20 0.36

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
SCHEMBL5761854 0.91 NPC1 (0.40) HDAC3NPC1RAB9A
SCHEMBL5762678 0.90 HPGD (0.39) NPC1RAB9A
SCHEMBL5762545 0.89 HPGD (0.38) NPC1RAB9AMEN1KMT2A
SCHEMBL5760247 0.89 CNR1 (0.37) FFAR1MAPTROCK2KDM4EMEN1
SCHEMBL6888684 0.86 FFAR1 (0.44) PLAAT5PLAAT4PLAAT3PLAAT2FFAR1
SCHEMBL5763387 0.83 PSMB5 (0.39) LMNAFFAR1MAPTROCK2NPC1
SCHEMBL5763139 0.81 PPARG (0.50) OPRM1OPRD1OPRK1
SCHEMBL1750119 0.81 PPARG (0.50) OPRM1OPRD1OPRK1
SCHEMBL1749756 0.80 PPARG (0.43) TP53LMNAOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL1750383 0.80 PPARG (0.49) OPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638964-A1 NOVEL COMPOUNDS THAT MODULATE PPAR-GAMMA TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2006-03-29 EP disclosed
WO-2004113331-A1 NOVEL COMPOUNDS THAT MODULATE PPARϜ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-12-29 WO disclosed