Isopropyl Alcohol

Isopropyl Alcohol

SCHEMBL8723907

CC(C)O.CCCCC(O)CCO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42
FFAR1 O14842 1/20 0.42
PSMD14 O00487 2/20 0.41
PLA2G1B P04054 2/20 0.41
MMP2 P08253 2/20 0.41
ATG4B Q9Y4P1 2/20 0.41
HSP90AA1 P07900 1/20 0.41
RAD52 P43351 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NFKB1 P19838 1/20 0.41
GPR84 Q9NQS5 5/20 0.39
FDPS P14324 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
OPRM1 P35372 1/20 0.39
LMNA P02545 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL3250197 0.95
SCHEMBL3248913 0.95
SCHEMBL427481 0.95
SCHEMBL27930888 0.92 THRB (0.46) THRBFFAR4FFAR1PSMD14PLA2G1B
SCHEMBL9385488 0.92 THRB (0.46) THRBFFAR4FFAR1PSMD14PLA2G1B
SCHEMBL12459736 0.87 FFAR4 (0.54) THRBFFAR4FFAR1PSMD14PLA2G1B
SCHEMBL5414027 0.87 FFAR4 (0.54) THRBFFAR4FFAR1PSMD14PLA2G1B
SCHEMBL304078 0.87 FFAR4 (0.54) THRBFFAR4FFAR1PSMD14PLA2G1B
SCHEMBL3177551 0.86 FFAR4 (0.48) FFAR4FFAR1PSMD14PLA2G1BMMP2
SCHEMBL23188459 0.85 FFAR4 (0.57) FFAR4FFAR1PSMD14PLA2G1BMMP2

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-0842250-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-05-20 EP disclosed
WO-1997003169-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed