Butylbenzyl

Butylbenzyl

SCHEMBL31498527

CCCCc1ccccc1.CCCCc1ccccc1.[Ni]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.57
KCNH2 Q12809 2/20 0.57
CHRM2 P08172 1/20 0.56
HTR1A P08908 1/20 0.56
ADRA2A P08913 1/20 0.56
CHRM1 P11229 1/20 0.56
DRD1 P21728 1/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
ADRA1A P35348 1/20 0.56
OPRM1 P35372 1/20 0.56
DRD3 P35462 1/20 0.56
SLC6A3 Q01959 1/20 0.56
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 1/20 0.54
HSD11B1 P28845 1/20 0.53
MAOA P21397 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MEN1 O00255 1/20 0.52

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
Butylbenzyl SCHEMBL3229215 0.97 SIGMAR1 (0.59) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL16051 0.97 SIGMAR1 (0.59) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL22716183 0.97 SIGMAR1 (0.59) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL9545214 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL11774005 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL363180 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL7713579 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL1357980 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL10925942 0.95 SIGMAR1 (0.57) SIGMAR1KCNH2CHRM2HTR1AADRA2A
Butylbenzyl SCHEMBL11606144 0.95 ALDH1A1 (0.59) SIGMAR1KCNH2CHRM2HTR1AADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096474-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. (US) 2025-05-08 WO claimed
WO-2025096472-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. (US) 2025-05-08 WO claimed
US-20250136631-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. 2025-05-01 US claimed
US-20250136630-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. 2025-05-01 US claimed
WO-2025096474-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. (US) 2025-05-08 WO disclosed
WO-2025096472-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. (US) 2025-05-08 WO disclosed
US-20250136631-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. 2025-05-01 US disclosed
US-20250136630-A1 METHODS FOR PURIFYING BIS (ARENE) NICKEL COMPLEXES AND RELATED PRODUCTS ENTEGRIS, INC. 2025-05-01 US disclosed