1-Heptanol

1-Heptanol

SCHEMBL28115487

CC(=O)OC(C)C.CCCCCCCO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
LMNA P02545 4/20 0.55
ALDH1A1 P00352 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.48
PRKCA P17252 2/20 0.46
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
FAAH O00519 2/20 0.41
ACHE P22303 3/20 0.40

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
1-Pentanol SCHEMBL11376862 0.98 TSHR (0.58) TSHRLMNAALDH1A1HSD17B10MEN1
Butyl Alcohol SCHEMBL15004902 0.92 TSHR (0.61) TSHRLMNAALDH1A1HSD17B10MEN1
Octane SCHEMBL10883673 0.92 TSHR (0.67) TSHRLMNAALDH1A1MEN1KMT2A
Heptane SCHEMBL2123028 0.92 TSHR (0.67) TSHRLMNAALDH1A1MEN1KMT2A
Heptane SCHEMBL350561 0.92 TSHR (0.67) TSHRLMNAALDH1A1MEN1KMT2A
Butyl Alcohol SCHEMBL28312338 0.90 TSHR (0.58) TSHRLMNAALDH1A1HSD17B10MEN1
Hexane SCHEMBL372207 0.89 TSHR (0.70) TSHRLMNAALDH1A1SMN1; SMN2PRKCA
Hexane SCHEMBL15841420 0.87 TSHR (0.67) TSHRLMNAALDH1A1SMN1; SMN2PRKCA
Pentane SCHEMBL4454016 0.85 TSHR (0.70) TSHRLMNAALDH1A1SMN1; SMN2PRKCA
Propanol SCHEMBL5373909 0.85 TSHR (0.70) TSHRLMNAALDH1A1HSD17B10SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103269826-B Lead-free solder scaling powder and lead-free solder paste 荒川化学工业株式会社 2016-12-07 CN disclosed