Butylbenzyl

Butylbenzyl

SCHEMBL6567724

CC1CCCCC1.CCCCc1ccccc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.51
ACHE P22303 1/20 0.49
SLC18A3 Q16572 1/20 0.45
EPHX2 P34913 1/20 0.45
EPHX1 P07099 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
Butylcyclohexane SCHEMBL28178048 0.83 CYP1A2 (0.60) SIGMAR1SLC18A3
Butylbenzyl SCHEMBL28122450 0.83 SIGMAR1 (0.54) SIGMAR1
Ethylbenzene SCHEMBL1114888 0.81 TP53 (0.58) SIGMAR1ACHEEPHX2L3MBTL1
Butylbenzyl SCHEMBL22716183 0.80 SIGMAR1 (0.59) SIGMAR1L3MBTL1
Butylbenzyl SCHEMBL3229215 0.80 SIGMAR1 (0.59) SIGMAR1L3MBTL1
Butylbenzyl SCHEMBL16051 0.80 SIGMAR1 (0.59) SIGMAR1L3MBTL1
Cyclohexane SCHEMBL28203222 0.79 KCNH2 (0.65) SIGMAR1ACHE
SCHEMBL29168791 0.79 KCNH2 (0.56) SIGMAR1ACHE
Butylbenzyl SCHEMBL10925942 0.78 SIGMAR1 (0.57) SIGMAR1L3MBTL1
Butylbenzyl SCHEMBL11774005 0.78 SIGMAR1 (0.57) SIGMAR1L3MBTL1

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-1402524-A2 SOLVENT COMPOSITION AND PROCESS FOR MANUFACTURING AN OPTICAL RECORDING MEDIUM USING SAID COMPOSITION AND OPTICAL RECORDING MEDIUM Ciba SC Holding AG (CH) 2004-03-31 EP disclosed
WO-2003034146-A2 SOLVENT COMPOSITION AND PROCESS FOR MANUFACTURING AN OPTICAL RECORDING MEDIUM USING SAID COMPOSITION AND OPTICAL RECORDING MEDIUM CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-04-24 WO disclosed