SCHEMBL9748433

SCHEMBL9748433

CC(C)CC/C=C\CCC=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.36
TRPV1 Q8NER1 2/20 0.36
ALDH1A1 P00352 1/20 0.35
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
TSHR P16473 1/20 0.32
HIF1A Q16665 3/20 0.32
EPAS1 Q99814 2/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL28450195 0.85 FAAH (0.43) FAAHTRPV1ALDH1A1ADH1BADH1C
SCHEMBL107778 0.83
SCHEMBL2840987 0.83 LMNA (0.35)
SCHEMBL1782552 0.82 TRPV1 (0.35) FAAHTRPV1HIF1AEPAS1
SCHEMBL1782551 0.82 TRPV1 (0.35) FAAHTRPV1HIF1AEPAS1
SCHEMBL29190497 0.80
SCHEMBL7844269 0.80
SCHEMBL28765622 0.80
SCHEMBL1010069 0.80
Methane SCHEMBL782703 0.80

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
JP-4009345-A None JP disclosed
JP-H049345-A 8-METHYL-4(Z)-NONENE DERIVATIVE T HASEGAWA CO LTD 1992-01-14 JP disclosed