SCHEMBL18327985

SCHEMBL18327985

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
POLB P06746 2/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NPC1 O15118 1/20 0.49
EPHX2 P34913 1/20 0.49
RAB9A P51151 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 3/20 0.47
CTBP2 P56545 1/20 0.47
LMNA P02545 1/20 0.47
ALOX15 P16050 1/20 0.47
APEX1 P27695 1/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL48525 0.88 HTT (0.66) HTTPOLBMEN1KMT2ANPC1
SCHEMBL28709451 0.88 HTT (0.66) HTTPOLBMEN1KMT2ANPC1
SCHEMBL9262585 0.82 HTT (0.59) HTTPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL9417745 0.82 HTT (0.59) HTTPOLBMEN1KMT2ASMN1; SMN2
SCHEMBL7149097 0.82 HTT (0.59) HTTPOLBMEN1KMT2AL3MBTL1
SCHEMBL18219806 0.81 HTT (0.47) HTTPOLBMEN1KMT2ANPC1
SCHEMBL18653847 0.80 KMT2A (0.61) HTTMEN1KMT2ANPC1EPHX2
SCHEMBL2620537 0.79 PPARG (0.47) HTTMEN1KMT2ANPC1EPHX2
SCHEMBL17451337 0.78 MEN1 (0.61) HTTMEN1KMT2ANPC1EPHX2
Propylene Glycol SCHEMBL29111692 0.78 POLB (0.62) HTTPOLBMEN1KMT2AL3MBTL1

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-9840585-B2 Polycarbonate resin composition LG CHEM, LTD. (KR) 2017-12-12 US disclosed
US-20170012225-A1 PLASTIC SUBSTRATE AND DISPLAY DEVICE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-12 US disclosed
US-20160369095-A1 POLYCARBONATE RESIN COMPOSITION LG CHEM, LTD. (KR) 2016-12-22 US disclosed