SCHEMBL13569415

SCHEMBL13569415

C=CC(=O)OC(COC(=O)C(=C)C)COc1ccc(-c2ccc(N(c3ccccc3)c3ccc(/C=C/c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.35
MAOB P27338 2/20 0.35
RELA Q04206 1/20 0.34
PPARA Q07869 1/20 0.34
PPARG P37231 1/20 0.34
NPC1 O15118 2/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
APP P05067 1/20 0.33
TRPM8 Q7Z2W7 2/20 0.33
MTOR P42345 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CHRNB2 P17787 1/20 0.32

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
SCHEMBL13569406 0.94 MAPT (0.35) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL6014302 0.94 MAOB (0.39) CTDSP1MAOBPPARAPPARGMAPT
SCHEMBL6014306 0.94 MAOB (0.39) CTDSP1MAOBPPARAPPARGMAPT
SCHEMBL13569404 0.92 AR (0.34) MAOBMAPTKMT2AMAPK1HPGD
SCHEMBL13569398 0.92 THRB (0.37) NPC1MAPTRAB9ALMNASMN1; SMN2
SCHEMBL13569405 0.91 MAPT (0.37) NPC1MAPTRAB9ALMNASMN1; SMN2
SCHEMBL13569417 0.90 MAPT (0.37) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL13569412 0.90 FFAR1 (0.37) PPARAPPARGKMT2ATRPM8TP53
SCHEMBL13569401 0.89 LTB4R2 (0.37) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL13569414 0.89 THRB (0.37) NPC1MAPTRAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629094-B2 Electrophotographic photoreceptor, and image forming method, image forming apparatus and process cartridge therefor using the electrophotographic photoreceptor RICOH COMPANY, LTD. (JP) 2009-12-08 US disclosed