SCHEMBL5764446

SCHEMBL5764446

CCCCCCCC(=O)N(C)Cc1ccc(-c2cccc(C)c2OC(=O)CC)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.36
ACHE P22303 4/20 0.36
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
POLM Q9NP87 2/20 0.34
POLK Q9UBT6 2/20 0.34
POLL Q9UGP5 2/20 0.34
POLH Q9Y253 2/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
MEN1 O00255 1/20 0.33
RIPK1 Q13546 1/20 0.33
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL1749611 0.72 FFAR4 (0.35) BCHEACHELMNAKMT2AALDH1A1
SCHEMBL1749181 0.71 HDAC3 (0.39) BCHEACHEKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1749772 0.70 ALDH1A1 (0.38) BCHEACHEALDH1A1RAB9APOLM
SCHEMBL1750306 0.69 RAB9A (0.43) BCHEACHEKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1750288 0.67 HDAC3 (0.39) BCHEACHEKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1749478 0.67 PPARA (0.43)
SCHEMBL1751993 0.65 SMN1; SMN2 (0.62) ACHEKMT2ASMN1; SMN2ALDH1A1MEN1
SCHEMBL67768 0.65 HSD17B2 (0.43) KMT2ARAB9AHDAC3HDAC1HDAC2
SCHEMBL15547532 0.64 POLM (0.56) KMT2ASMN1; SMN2POLMPOLKPOLL
SCHEMBL17938479 0.64 POLM (0.56) KMT2ASMN1; SMN2POLMPOLKPOLL

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
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 claimed
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 claimed
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