SCHEMBL6453784

SCHEMBL6453784

CC(C)(C)c1cc(CCC(=O)OCCN2C(C)(C)CC(OC(=O)CCc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)CC2(C)C)cc(C(C)(C)C)c1O.CC1(C)CC(OC(=O)c2ccccc2)CC(C)(C)N1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.48
TSHR P16473 2/20 0.39
MAOB P27338 3/20 0.37
MAOA P21397 2/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
AGTR1 P30556 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ACHE P22303 1/20 0.35
KMT2A Q03164 4/20 0.35
NPC1L1 Q9UHC9 1/20 0.35
ALOX5 P09917 1/20 0.35
MEN1 O00255 3/20 0.34
CHRNA7 P36544 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
ABCB1 P08183 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
SCHEMBL2958675 0.89 ALOX5 (0.44) GAAMAOBMAOAALDH1A1LMNA
SCHEMBL206978 0.87 KMT2A (0.43) GAATSHRMAOBMAOAALDH1A1
SCHEMBL5946403 0.84 GAA (0.43) GAATSHRKMT2ANPC1L1CHRNA7
SCHEMBL2998267 0.83 APP (0.40) GAAMAOBMAOAALDH1A1LMNA
SCHEMBL10348415 0.81 GAA (0.46) GAATSHRMAOBMAOAALDH1A1
SCHEMBL9410294 0.81 TSHR (0.41) GAATSHRMAOBMAOAALDH1A1
SCHEMBL17866245 0.80 KMT2A (0.38) GAAMAOBMAOAALDH1A1LMNA
SCHEMBL4302639 0.80 KMT2A (0.37) GAAMAOBMAOAALDH1A1HTT
SCHEMBL5008540 0.80 KMT2A (0.37) GAAMAOBMAOAALDH1A1HTT
SCHEMBL5415495 0.79 GAA (0.37) GAAMAOBMAOAALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130052423-A1 PHOTOSENSITIVE COMPOSITION, METHOD FOR MANUFACTURING MOLDED ARTICLE, MOLDED ARTICLE AND SEMICONDUCTOR DEVICE JSR CORPORATION (JP) 2013-02-28 US disclosed
EP-0735596-B1 SOLAR BATTERY DEVICE CITIZEN WATCH CO LTD (JP) 2005-03-16 EP disclosed
EP-0831537-A2 Solar battery device CITIZEN WATCH CO. LTD. (JP) 1998-03-25 EP disclosed
EP-0735596-A1 SOLAR BATTERY DEVICE CITIZEN WATCH CO. LTD. (JP) 1996-10-02 EP disclosed