(Z)-Hex-3-En-1-Yl Acetate

(Z)-Hex-3-En-1-Yl Acetate

SCHEMBL28969715

CC/C=C\CCOC(=O)c1ccccc1.CC/C=C\CCOC(C)=O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
TDP1 Q9NUW8 3/20 0.51
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MAPK1 P28482 2/20 0.42
SLC6A2 P23975 2/20 0.42
HIF1A Q16665 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
F2 P00734 1/20 0.42
ALDH1A1 P00352 3/20 0.41
PKM P14618 1/20 0.41
ESR1 P03372 2/20 0.41
CHRM1 P11229 1/20 0.41
KDR P35968 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
GAA P10253 1/20 0.40
ESR2 Q92731 1/20 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
SCHEMBL1771682 0.94 LMNA (0.64) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL130435 0.94 LMNA (0.64) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL130434 0.94 LMNA (0.64) LMNATDP1TSHRSMN1; SMN2MAPK1
Benzoic Acid SCHEMBL1864558 0.90 LMNA (0.58) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23748454 0.87 LMNA (0.54) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL30285512 0.84 LMNA (0.69) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL3751591 0.84 TDP1 (0.67) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL3751588 0.84 TDP1 (0.67) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL27491796 0.82 TDP1 (0.65) LMNATDP1TSHRSMN1; SMN2MAPK1
SCHEMBL3958327 0.82 LMNA (0.69) LMNATDP1TSHRSMN1; SMN2MAPK1

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-115836061-A Odorants and compositions comprising odorants 丝趣科尔卡有限公司 2023-03-21 CN disclosed