SCHEMBL11340693

SCHEMBL11340693

CCCCCc1noc(CC)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 7/20 0.41
CHRM4 P08173 7/20 0.41
CHRM5 P08912 7/20 0.41
CHRM1 P11229 7/20 0.41
CHRM3 P20309 7/20 0.41
PPARA Q07869 1/20 0.39
SPHK2 Q9NRA0 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
SPHK1 Q9NYA1 1/20 0.35
KCNH2 Q12809 1/20 0.34
GPR84 Q9NQS5 1/20 0.34

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
SCHEMBL369393 0.90 PPARA (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3034540 0.85 KDM4E (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6206207 0.85 L3MBTL1 (0.35) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL25214137 0.85 CHRM2 (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL23588014 0.83 CHRM2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL23578316 0.83 CHRM2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3037891 0.82 PPARA (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3037363 0.80 PPARA (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL13247918 0.79 L3MBTL1 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7953996 0.79 ALDH1A1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3

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-56125378-A None JP disclosed
JP-S56125378-A OXADIAZOLE DERIVATIVE MITSUBISHI CHEM IND LTD 1981-10-01 JP disclosed