Isopropyl Alcohol

Isopropyl Alcohol

SCHEMBL28049359

C=CC(=O)NC.CC(C)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.54
ALDH1A1 P00352 5/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
TGM2 P21980 6/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
LMNA P02545 3/20 0.32
CYP2C19 P33261 1/20 0.31
TP53 P04637 1/20 0.30
FGFR4 P22455 1/20 0.30
F13A1 P00488 1/20 0.30
TGM1 P22735 1/20 0.30
TGM3 Q08188 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
Isobutane SCHEMBL3224171 0.92 TSHR (0.56) TSHRALDH1A1MAPK1TDP1CHRNB2
SCHEMBL4354008 0.89 TSHR (0.50) TSHRALDH1A1MAPK1TDP1CHRNB2
SCHEMBL15004 0.89
Ethylene SCHEMBL28093426 0.86
Methyl Alcohol SCHEMBL28641407 0.86 TSHR (0.48) TSHRALDH1A1MAPK1TDP1CHRNB2
Methyl Alcohol SCHEMBL28509086 0.86
Water SCHEMBL27402089 0.86
Dimethylamine SCHEMBL543057 0.86
Hydrochloric Acid SCHEMBL4773602 0.86
SCHEMBL30637266 0.86

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
CN-105273725-B Aligning agent for liquid crystal, liquid crystal orientation film and liquid crystal display element JSR株式会社 2018-07-24 CN disclosed
CN-105273725-A LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORP 2016-01-27 CN disclosed