SCHEMBL9821146

SCHEMBL9821146

C1CCC(CC2(CC3CCCCC3)CCCCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.33
CYP1A2 P05177 1/20 0.33
ADRA2C P18825 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
SIGMAR1 Q99720 7/20 0.32
SCN1A P35498 1/20 0.32
SCN4A P35499 1/20 0.32
SCN7A Q01118 1/20 0.32
KCNH2 Q12809 1/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
SCN2A Q99250 1/20 0.32
SCN3A Q9NY46 1/20 0.32
SCN11A Q9UI33 1/20 0.32
SCN8A Q9UQD0 1/20 0.32
SCN10A Q9Y5Y9 1/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 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
SCHEMBL31118157 0.80 USP2 (0.38) CYP1A2SIGMAR1
SCHEMBL8977694 0.80 SIGMAR1 (0.31) SIGMAR1
SCHEMBL21649725 0.80 SIGMAR1 (0.33) CYP1A2SIGMAR1
SCHEMBL22447924 0.77 MGAM (0.32) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL22330665 0.74 CHRM5 (0.31) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL4814952 0.74 CYP1A2 (0.36) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL11849600 0.74 SIGMAR1 (0.33) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL21423141 0.72 SIGMAR1 (0.38) CYP1A2SIGMAR1OPRM1OPRL1
SCHEMBL11014349 0.72 SIGMAR1 (0.30) CHRM5CYP1A2ADRA2CCHRM2CHRM4
SCHEMBL10811573 0.72 CHRM5 (0.30) CHRM5CYP1A2ADRA2CCHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208541-B1 LUBRICANT COMPOSITIONS NIPPON OIL CO. LTD. (JP) 1991-12-04 EP claimed
EP-0208541-A2 Lubricant compositions NIPPON OIL CO. LTD. (JP) 1987-01-14 EP claimed
CN-113122059-A Preparation method of ink and quantum dot film TCL集团股份有限公司 2021-07-16 CN disclosed
EP-0208541-B1 LUBRICANT COMPOSITIONS NIPPON OIL CO. LTD. (JP) 1991-12-04 EP disclosed
EP-0208541-A2 Lubricant compositions NIPPON OIL CO. LTD. (JP) 1987-01-14 EP disclosed