SCHEMBL3364573

SCHEMBL3364573

CCOC(=O)OC(C(=O)c1cc(OC)cc(OC)c1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
NPC1 O15118 3/20 0.52
POLB P06746 2/20 0.52
RAB9A P51151 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GAA P10253 1/20 0.48
ALDH1A1 P00352 5/20 0.47
CYP3A4 P08684 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
GPR139 Q6DWJ6 1/20 0.44
TACR1 P25103 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 2/20 0.43
MAPK1 P28482 1/20 0.43
ADRB2 P07550 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL22157293 0.90 MEN1 (0.52) MAPTMEN1KMT2ANPC1POLB
SCHEMBL291492 0.89 MEN1 (0.59) MAPTMEN1KMT2ANPC1POLB
SCHEMBL9475631 0.85 ALDH1A1 (0.64) MAPTMEN1KMT2ANPC1POLB
SCHEMBL291491 0.84 MEN1 (0.59) MAPTMEN1KMT2ANPC1POLB
SCHEMBL3368374 0.82 ALDH1A1 (0.69) MAPTMEN1KMT2ANPC1POLB
SCHEMBL7148678 0.82 MEN1 (0.58) MAPTMEN1KMT2ANPC1POLB
SCHEMBL28343387 0.81 MEN1 (0.57) MAPTMEN1KMT2ANPC1POLB
SCHEMBL11791194 0.79 PPARA (0.49) MEN1KMT2ANPC1POLBGAA
SCHEMBL2779581 0.78 MEN1 (0.59) MAPTMEN1KMT2ANPC1POLB
SCHEMBL10353075 0.78 MEN1 (0.53) MAPTMEN1KMT2ANPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1617812-B1 PHOTORESPONSIVE FRAGRANCES PHO DERMA INC (US) 2010-10-06 EP disclosed
EP-1021159-B1 PHOTORESPONSIVE SUNSCREEN COMPOSITIONS CALIFORNIA INST OF TECHN (US) 2006-07-12 EP disclosed
EP-1617812-A2 PHOTORESPONSIVE FRAGRANCES Pho Derma, Inc. (US) 2006-01-25 EP disclosed
US-20050020459-A1 Carrier solution for cleaning purposes or topical applying SOLARBRE, INC. 2005-01-27 US disclosed
WO-2004084853-A2 PHOTORESPONSIVE FRAGRANCES PHO DERMA, INC. (US) 2004-10-07 WO disclosed
US-6280711-B1 INTRAMOLECULAR PHOTOCHEMICAL REARRANGEMENTS INDUCED BY ULTRAVIOLET RADIATION; TOPICAL CALIFORNIA INSTITUTE OF TECHNOLOGY 2001-08-28 US disclosed
EP-1021159-A1 PHOTORESPONSIVE SUNSCREEN COMPOSITIONS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-07-26 EP disclosed
US-6022529-A Photoresponsive sunscreen compositions CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-02-08 US disclosed
WO-1999007336-A1 PHOTORESPONSIVE SUNSCREEN COMPOSITIONS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1999-02-18 WO disclosed