SCHEMBL9191963

SCHEMBL9191963

CCC(O)COc1cc(C)ccc1C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.48
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
TP53 P04637 1/20 0.42
ADRB2 P07550 2/20 0.41
TSHR P16473 1/20 0.40
ACHE P22303 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AR P10275 1/20 0.39
VDR P11473 1/20 0.39

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
SCHEMBL772788 0.87 USP2 (0.50) USP2MEN1LMNAKMT2AMRGPRX4
SCHEMBL14850377 0.80 MAPT (0.41) USP2MEN1KMT2AL3MBTL1MAPT
SCHEMBL29664528 0.80 MAPT (0.67) MEN1LMNAKMT2AL3MBTL1MAPT
SCHEMBL9192493 0.80 MAPT (0.67) MEN1LMNAKMT2AL3MBTL1MAPT
SCHEMBL13064444 0.79 L3MBTL1 (0.54) MEN1KMT2AMRGPRX4L3MBTL1HTT
SCHEMBL16348227 0.78 ACHE (0.53) USP2MEN1LMNAKMT2AL3MBTL1
SCHEMBL17207217 0.77 L3MBTL1 (0.52) USP2MEN1KMT2AMRGPRX4L3MBTL1
SCHEMBL10635979 0.75 ALDH1A1 (0.49) USP2MEN1KMT2AHTTNPSR1
SCHEMBL14301030 0.75 ABCB1 (0.46) MEN1LMNAKMT2AL3MBTL1HTT
SCHEMBL768528 0.75 USP2 (0.62) USP2MEN1LMNAKMT2AL3MBTL1

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
EP-0467290-B1 Alpha-(alkylcyclohexyloxy)-beta-alkanols and perfume compositions containing the same KAO CORP (JP) 1995-10-11 EP disclosed
US-5194423-A ALPHA-(ALKYLCYCLOHEXYLOXY)-BETA-ALKANOLS AND PERFUME COMPOSITIONS CONTAINING THE SAME KAO CORPORATION (JP) 1993-03-16 US disclosed
EP-0467290-A2 Alpha-(alkylcyclohexyloxy)-beta-alkanols and perfume compositions containing the same Kao Corporation (JP) 1992-01-22 EP disclosed