Butyl Alcohol

Butyl Alcohol

SCHEMBL6183785

CCCCO.CCOC(=O)C(CO)CCO

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.44
ALDH1A1 P00352 1/20 0.41
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
CHRM1 P11229 1/20 0.34
AKR1A1 P14550 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL1405922 0.90 CPB2 (0.42) CPB2ALDH1A1CYP4F2CYP4A11MEN1
SCHEMBL3176263 0.86 CA2 (0.52) CPB2ALDH1A1CA2CA1TDP1
SCHEMBL5000143 0.86 CPB2 (0.47) CPB2ALDH1A1CA2CA1CYP4F2
SCHEMBL27813936 0.86 HDAC1 (0.46) CPB2ALDH1A1CA2CA1CHRM1
SCHEMBL3845206 0.85 CPB2 (0.50) CPB2CA2CA1MAPK1MEN1
SCHEMBL17523695 0.84 HDAC1 (0.44) CPB2ALDH1A1CA2CA1CYP4F2
SCHEMBL28078262 0.84 HDAC1 (0.44) CPB2ALDH1A1CA2CA1CYP4F2
SCHEMBL277442 0.83 CPB2 (0.53) CPB2CA2CA1MAPK1MEN1
SCHEMBL319980 0.83 CPB2 (0.53) CPB2CA2CA1MAPK1MEN1
SCHEMBL11132482 0.83 ALDH1A1 (0.47) ALDH1A1CA2CA1HDAC1HDAC2

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-1546146-A1 POLYMORPHIC FORMS OF ZIPRASIDONE HCl AND PROCESSES FOR THEIR PREPARATION Teva Pharmaceutical Industries Limited (IL) 2005-06-29 EP disclosed
WO-2005035531-A1 POLYMORPHIC FORMS OF ZIPRASIDONE HCl AND PROCESSES FOR THEIR PREPARATION TEVA PAHARMACEUTICAL INDUSTRIES LTD. (IL) 2005-04-21 WO disclosed