SCHEMBL382380

SCHEMBL382380

CCOC(=O)c1ccc(-c2ccc(OCCCO[Si](C)(C)C(C)(C)C)cc2)cc1-c1ccc(N(CC)CC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.42
RARG P13631 4/20 0.42
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAOB P27338 1/20 0.38
DHFR P00374 1/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
RARA P10276 4/20 0.34
PGR P06401 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL382090 0.87 RARA (0.48) RARBRARGNPC1LMNARAB9A
SCHEMBL382839 0.86 RARG (0.44) RARBRARGMAOBMAPTTP53
SCHEMBL382244 0.85 RARB (0.56) RARBRARGNPC1LMNARAB9A
SCHEMBL381770 0.84 RARG (0.58) RARBRARGDHFRMAPTRARA
SCHEMBL382163 0.83 HRH3 (0.43) NPC1LMNARAB9AHSD17B10MAPT
SCHEMBL382994 0.80 RARA (0.51) RARBRARGNPC1LMNARAB9A
SCHEMBL4577375 0.79 RARB (0.51) RARBRARGNPC1RAB9ASMN1; SMN2
SCHEMBL383525 0.74 RARG (0.62) RARBRARGNPC1LMNARAB9A
SCHEMBL382740 0.73 RARG (0.61) RARBRARGDHFRMAPTRARA
SCHEMBL380874 0.72 RARA (0.51) RARBRARGNPC1LMNARAB9A

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
EP-1831149-B1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2012-01-25 EP disclosed