SCHEMBL5813245

SCHEMBL5813245

Cc1ccc(C(=O)C(C)N2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
ALDH1A1 P00352 2/20 0.53
TP53 P04637 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GLA P06280 1/20 0.53
MAPT P10636 1/20 0.53
CYP2D6 P10635 1/20 0.53
LMNA P02545 2/20 0.51
HRH3 Q9Y5N1 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PKM P14618 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
SLC6A3 Q01959 4/20 0.49
SLC6A2 P23975 3/20 0.49
SLC6A4 P31645 2/20 0.49
CHRNA1 P02708 1/20 0.49

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
SCHEMBL3424629 0.86 ALDH1A1 (0.51) RAB9ANPC1ALDH1A1TP53SMN1; SMN2
SCHEMBL10469275 0.86 HRH3 (0.49) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL5954184 0.86 PHGDH (0.55) RAB9ANPC1ALDH1A1TP53SMN1; SMN2
SCHEMBL321368 0.85 ALDH1A1 (0.67) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL17644179 0.85 SLC6A3 (0.65) ALDH1A1SMN1; SMN2MAPTLMNAHRH3
SCHEMBL895863 0.85 SLC6A3 (0.65) ALDH1A1SMN1; SMN2MAPTLMNAHRH3
Hydrochloric Acid SCHEMBL9596868 0.84 HRH3 (0.48) ALDH1A1SMN1; SMN2MAPTLMNAHRH3
Hydrochloric Acid SCHEMBL10943241 0.84 ALDH1A1 (0.65) RAB9ANPC1ALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL17645636 0.83 SLC6A3 (0.63) ALDH1A1SMN1; SMN2MAPTLMNAHRH3
SCHEMBL29136256 0.83 HRH3 (0.47) RAB9ANPC1ALDH1A1TP53SMN1; SMN2

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
WO-2006098424-A1 ANTIREFLECTION FILM, PRODUCTION METHOD THEREOF, POLARIZING PLATE USING THE ANTIREFLECTION FILM AND IMAGE DISPLAY DEVICE USING THE ANTIREFLECTION FILM OR POLARIZING PLATE FUJIFILM CORPORATION (JP) 2006-09-21 WO disclosed
US-5034301-A Optical recording media on a support for light or heat sensitive element CANON KABUSHIKI KAISHA (JP) 1991-07-23 US disclosed