SCHEMBL2443833

SCHEMBL2443833

CC(C)CC(=O)CCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.59
HDAC1 Q13547 4/20 0.58
HDAC3 O15379 3/20 0.58
HDAC2 Q92769 3/20 0.58
HDAC8 Q9BY41 3/20 0.58
HDAC6 Q9UBN7 3/20 0.58
HDAC5 Q9UQL6 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
HDAC4 P56524 2/20 0.58
HDAC7 Q8WUI4 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC9 Q9UKV0 2/20 0.58
MAPK1 P28482 1/20 0.58
ADRA1A P35348 1/20 0.58
SLC6A3 Q01959 1/20 0.58
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 2/20 0.58
LMNA P02545 1/20 0.56
PKM P14618 1/20 0.56

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
SCHEMBL7007779 0.93 MAPT (0.61) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL110046 0.89 TRPA1 (0.64) HPGDHDAC2HDAC8HDAC6KMT2A
SCHEMBL6572384 0.84 LMNA (0.63) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL5674267 0.82 HDAC1 (0.75) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL7645395 0.81 TRPA1 (0.61) HPGDHDAC1HDAC2KMT2AALDH1A1
SCHEMBL28961746 0.81 CAPN1 (0.52) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL26616560 0.81 SMN1; SMN2 (0.49) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL3642535 0.79 HDAC1 (0.64) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL3091093 0.79 TRPA1 (0.55) HPGDHDAC1HDAC3HDAC2HDAC8
SCHEMBL6571377 0.79 LMNA (0.57) HPGDHDAC1HDAC3HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362765-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-07 EP claimed
WO-2010065446-A2 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2010-06-10 WO claimed