SCHEMBL2355696

SCHEMBL2355696

COc1ccc(C(=O)C(C)(C)C(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.70
ALDH1A1 P00352 3/20 0.68
TDP1 Q9NUW8 2/20 0.68
ALOX15 P16050 2/20 0.68
LMNA P02545 1/20 0.68
APEX1 P27695 1/20 0.68
MAPK1 P28482 1/20 0.68
RECQL P46063 1/20 0.68
HSD17B10 Q99714 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.59
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
MEN1 O00255 1/20 0.59
EPHX2 P34913 1/20 0.59
KMT2A Q03164 1/20 0.59
NR1H4 Q96RI1 1/20 0.59
KDM4E B2RXH2 1/20 0.54
HTT P42858 1/20 0.54
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52

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
SCHEMBL395599 0.85 MAPT (0.74) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL19830567 0.85 MAPT (0.74) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL5342481 0.82 MAPT (0.70) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL9041537 0.82 MAPT (0.81) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL25471518 0.81 MAPT (0.68) MAPTALDH1A1TDP1ALOX15LMNA
Avobenzone SCHEMBL15650 0.81 ALDH1A1 (1.00) MAPTALDH1A1TDP1ALOX15LMNA
Avobenzone SCHEMBL1768910 0.81 ALDH1A1 (1.00) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL9403511 0.81 MAPT (0.68) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL22241270 0.81 ALDH1A1 (0.81) MAPTALDH1A1TDP1ALOX15LMNA
SCHEMBL78643 0.80 MAPT (0.64) MAPTALDH1A1TDP1ALOX15LMNA

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
EP-1635777-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GmbH (DE) 2006-03-22 EP claimed
WO-2004105712-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GMBH (DE) 2004-12-09 WO claimed
EP-2350182-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HallStar Innovations Corp. (US) 2011-08-03 EP disclosed
WO-2010051103-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HALLSTAR INNOVATIONS CORP. (US) 2010-05-06 WO disclosed