SCHEMBL6255353

SCHEMBL6255353

CCCCCCCC(=O)N(C)CCc1ccc(F)c(-c2ccc(Nc3ccccc3C(=O)O)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 11/20 0.45
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LTB4R Q15722 1/20 0.41
PLK1 P53350 4/20 0.41
HCAR2 Q8TDS4 1/20 0.41
RARB P10826 2/20 0.40
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
AGTR1 P30556 1/20 0.40
PLK3 Q9H4B4 3/20 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
SCHEMBL5374060 0.91 LTB4R2 (0.49) LTB4R2PLK1AGTR1
SCHEMBL5358339 0.81 LTB4R2 (0.44) LTB4R2RARBRARARARG
SCHEMBL5360863 0.77 AOC3 (0.48) LTB4R2
SCHEMBL5374067 0.76 LTB4R2 (0.42) LTB4R2MEN1RECQLBLMKMT2A
SCHEMBL5355948 0.76 AOC3 (0.49) LTB4R2
SCHEMBL6251973 0.76 ABCC1 (0.44) LTB4R2MEN1RECQLBLMKMT2A
SCHEMBL6256861 0.73 NPC1 (0.38)
SCHEMBL4248139 0.73 PLK1 (0.72) MEN1RECQLBLMKMT2ATDP1
SCHEMBL6483217 0.72 PLK1 (0.70) MEN1RECQLBLMKMT2ATDP1
SCHEMBL3439045 0.72 PPARG (0.48) MEN1BLMKMT2ATDP1

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-1572629-A1 COMPOUNDS WHICH MODULATE PPARϝ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2005-09-14 EP claimed
WO-2004052840-A1 COMPOUNDS WHICH MODULATE PPARϜ TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-06-24 WO claimed