SCHEMBL2638459

SCHEMBL2638459

CC(=Cc1ccccc1)C(=O)N(C)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.66
HTT P42858 1/20 0.50
DHODH Q02127 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
AKR1C1 Q04828 1/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RECQL P46063 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
FBP1 P09467 1/20 0.42
GLA P06280 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
F2 P00734 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL11226138 0.86 AKR1C3 (0.61) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL11226135 0.86 AKR1C3 (0.61) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL1629856 0.81 AKR1C3 (0.64) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL581982 0.80 AKR1C3 (1.00) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL41906 0.80 AKR1C3 (1.00) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL37034 0.80 AKR1C3 (1.00) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL16568719 0.80 AKR1C3 (1.00) AKR1C3HTTDHODHTRPM8ALDH1A1
Ammonia Solution, Strong SCHEMBL6327037 0.78 AKR1C3 (0.95) AKR1C3HTTDHODHTRPM8ALDH1A1
Acetic Acid SCHEMBL6897109 0.78 AKR1C3 (0.95) AKR1C3HTTDHODHTRPM8ALDH1A1
SCHEMBL27719681 0.78 AKR1C3 (0.95) AKR1C3HTTDHODHTRPM8ALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4748806-B2 2011-08-17 JP claimed
US-7211316-B2 Optical multilayer NITTO DENKO CORPORATION (JP) 2007-05-01 US claimed
WO-2005121848-A1 MULTILAYERED OPTICAL COMPENSATOR FILM WITH AMORPHOUS POLYMER FOR LIQUID CRYSTAL DISPLAYS NITTO DENKO CORPORATION (JP) 2005-12-22 WO claimed
WO-2005045820-A1 OPTICAL MULTILAYER EASTMAN KODAK COMPANY (US) 2005-05-19 WO claimed
US-20050089676-A1 Optical multilayer EASTMAN KODAK COMPANY 2005-04-28 US claimed
WO-2007001999-A1 MULTILAYERED OPTICAL COMPENSATOR NITTO DENKO CORPORATION (JP) 2007-01-04 WO disclosed