SCHEMBL27650549

SCHEMBL27650549

CCCCCC(CC)[N+](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.40
LMNA P02545 1/20 0.37
DNM1 Q05193 9/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
SLC22A1 O15245 2/20 0.35
SLC22A2 O15244 1/20 0.35
FDPS P14324 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
SCHEMBL2339806 0.97 LMNA (0.41) OPRM1LMNADNM1HTTTSHR
SCHEMBL8327147 0.97 LMNA (0.41) OPRM1LMNADNM1HTTTSHR
SCHEMBL15310044 0.97 LMNA (0.41) OPRM1LMNADNM1HTTTSHR
Bromide SCHEMBL21253076 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Hydrochloric Acid SCHEMBL114418 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Hydrochloric Acid SCHEMBL9465437 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Bromide SCHEMBL8402695 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Bromide SCHEMBL21247653 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Bromide SCHEMBL21253115 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR
Hydrochloric Acid SCHEMBL21253135 0.95 DNM1 (0.42) OPRM1LMNADNM1HTTTSHR

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-1791386-A Small-particle pharmaceutical formulations of antiseizure and antidementia agents and immunosuppressive agents BAXTER INT (US) 2006-06-21 CN disclosed