SCHEMBL7540680

SCHEMBL7540680

CCCON=C1CCCCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
MEN1 O00255 1/20 0.34
FAAH O00519 1/20 0.34
ABHD16A O95870 1/20 0.34
KMT2A Q03164 1/20 0.34
PLA2G7 Q13093 1/20 0.34
NCEH1 Q6PIU2 1/20 0.34
DAGLB Q8NCG7 1/20 0.34
DAGLA Q9Y4D2 1/20 0.34
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
ALDH1A1 P00352 2/20 0.32
GAA P10253 2/20 0.32

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
SCHEMBL13488624 0.87 ESR1 (0.37) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL28889986 0.85 MEN1 (0.35) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL11327111 0.84 MEN1 (0.38) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL11382530 0.83 CYP1A2 (0.35) CHRM2CHRM1KMT2AALDH1A1
SCHEMBL7541983 0.81 KMT2A (0.36) MEN1FAAHABHD16AKMT2APLA2G7
SCHEMBL14922373 0.78 CHRM2 (0.34) CHRM2CHRM1
SCHEMBL2993374 0.78 CHRM2 (0.34) CHRM2CHRM1
SCHEMBL12465180 0.78
SCHEMBL11381061 0.78 HRH3 (0.38) CHRM2CHRM1MEN1KMT2ATSHR
SCHEMBL11127644 0.77 TSHR (0.39) MEN1FAAHABHD16AKMT2APLA2G7

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
EP-0672746-B1 Oxime ethers and perfume and flavouring compositions containing them GIVAUDAN SA (CH) 2002-05-29 EP claimed