SCHEMBL8364440

SCHEMBL8364440

CC(CO)C1CCC(C(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPA P38571 1/20 0.38
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2D6 P10635 1/20 0.33
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
TRPV3 Q8NET8 1/20 0.33
EPHX1 P07099 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSD11B1 P28845 1/20 0.32
CDC25B P30305 1/20 0.30
ALPL P05186 1/20 0.30
ALPI P09923 1/20 0.30
ALPG P10696 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL8056802 0.83
SCHEMBL16712669 0.83
SCHEMBL140296 0.83
SCHEMBL8361524 0.82 KDM4E (0.36) HTTALDH1A1
SCHEMBL24788892 0.80 LIPA (0.35) LIPAHTTMEN1KMT2ACYP2D6
SCHEMBL7009861 0.79 MEN1 (0.39) LIPAHTTMEN1KMT2ACYP2D6
SCHEMBL11452012 0.79 MEN1 (0.39) LIPAHTTMEN1KMT2ACYP2D6
SCHEMBL11459167 0.79 MEN1 (0.39) LIPAHTTMEN1KMT2ACYP2D6
SCHEMBL2662621 0.78 HTT (0.36) LIPAHTTMEN1KMT2ATRPV3
SCHEMBL11562832 0.78 LIPA (0.34) LIPAHTTMEN1KMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925269-A1 SUBSTITUTED 2-CYCLOHEXYL-PROPAN-1-OL AND ITS USE IN PERFUME COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 1999-06-30 EP disclosed
WO-1998009933-A8 SUBSTITUTED 2-CYCLOHEXYL-PROPAN-1-OL AND ITS USE IN PERFUME COMPOSITIONS QUEST INT (NL) 1999-06-10 WO disclosed
WO-1998009933-A1 SUBSTITUTED 2-CYCLOHEXYL-PROPAN-1-OL AND ITS USE IN PERFUME COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 1998-03-12 WO disclosed
EP-0328116-B1 2-(ALKYL-CYCLOHEXYL)-1-PROPANOL, A PROCESS FOR PREPARING THE SAME, AND PERFUMERY COMPOSITION CONTAINING THE SAME KAO CORPORATION (JP) 1993-04-07 EP disclosed
US-5104851-A Long lasting floral or woody odors for soaps, detergents, shampoo KAO CORPORATION (JP) 1992-04-14 US disclosed
EP-0328116-A1 2-(alkyl-cyclohexyl)-1-propanol, a process for preparing the same, and perfumery composition containing the same KAO CORPORATION (JP) 1989-08-16 EP disclosed