SCHEMBL28535600

SCHEMBL28535600

CCCCCCCCCCCCCCCCCC(=O)OC1CCC(C)(C)N(OC2CCCCC2)C1(C)C

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.58
STAT3 P40763 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PRKCA P17252 5/20 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
SCHEMBL28527327 0.95 NAAA (0.49) NAAASTAT3SMN1; SMN2LMNAMAPT
SCHEMBL29290143 0.91 NAAA (0.45) NAAASMN1; SMN2
SCHEMBL6719535 0.89 NAAA (0.39) NAAASMN1; SMN2LMNAMEN1ALDH1A1
SCHEMBL28542236 0.83 NAAA (0.47) NAAASTAT3LMNAMAPTPRKCA
SCHEMBL194536 0.83 NAAA (0.47) NAAASTAT3LMNAMAPTPRKCA
SCHEMBL20194432 0.82 NAAA (0.66) NAAASMN1; SMN2MEN1KMT2APRKCA
SCHEMBL1232050 0.82 NAAA (0.66) NAAASMN1; SMN2MEN1KMT2APRKCA
SCHEMBL4348704 0.80 NAAA (0.49) NAAASTAT3LMNAMAPTPRKCA
SCHEMBL194331 0.80 NAAA (0.42) NAAASTAT3LMNAMAPTMEN1
SCHEMBL7069050 0.80 NAAA (0.43) NAAASTAT3LMNAMAPTPRKCA

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-109563335-B Polycarbonate resin composition 三菱工程塑料株式会社 2021-03-23 CN disclosed