SCHEMBL2268368

SCHEMBL2268368

COc1ccc(C(=O)C(C(=O)c2ccc(C(C)(C)C)cc2)C(C(=O)c2ccc(OC)cc2)C(=O)c2cc(C(C)C)ccc2C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 1/20 0.46
ALOX15 P16050 1/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NR1H4 Q96RI1 3/20 0.45
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
EPHX2 P34913 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40

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
SCHEMBL4663944 0.97 MAPT (0.43) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL2065160 0.82 MAPT (0.52) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL5771884 0.82 NR1H4 (0.45) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL3795638 0.80 ALDH1A1 (0.60) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL7162385 0.76 MAPT (0.60) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL9353462 0.74 MAPT (0.66) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL269577 0.73 NPC1 (0.52) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL15080783 0.72 MAPT (0.56) MAPTALDH1A1LMNAMAPK1RAB9A
SCHEMBL3098687 0.72 MAPT (0.59) MAPTALDH1A1HSD17B10LMNAALOX15
SCHEMBL10975203 0.72 MAPT (0.51) MAPTALDH1A1HSD17B10LMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003082-B2 Photostable organic sunscreen composition MERCK PATENT GMBH (DE) 2011-08-23 US claimed
EP-1635777-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GmbH (DE) 2006-03-22 EP disclosed
WO-2004105712-A1 PHOTOSTABLE ORGANIC SUNSCREEN COMPOSITION MERCK PATENT GMBH (DE) 2004-12-09 WO disclosed