SCHEMBL29134093

SCHEMBL29134093

CCCCCCCCN(CCCCCCCC)OC(=O)CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.42
NAAA Q02083 1/20 0.42
DGKA P23743 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 4/20 0.39
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
KDM5A P29375 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PAM P19021 2/20 0.38
GPR84 Q9NQS5 2/20 0.38
PPARG P37231 2/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38

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
SCHEMBL7799203 0.90 DNM1 (0.46) DNM1DGKALMNACES2CES1
SCHEMBL24728779 0.89 DNM1 (0.47) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL30964709 0.89 DNM1 (0.44) DNM1DGKALMNACES2CES1
SCHEMBL28657236 0.89 DGKA (0.53) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL20836044 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL19715022 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL25420701 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL19714861 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL15417811 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA
SCHEMBL29039158 0.87 DGKA (0.52) DNM1DGKAMAPTMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116840360-A Method for detecting unbound bilirubin concentration and typing in trace blood by using high performance liquid chromatograph 吉林大学 2023-10-03 CN claimed
CN-116840360-A Method for detecting unbound bilirubin concentration and typing in trace blood by using high performance liquid chromatograph 吉林大学 2023-10-03 CN disclosed
CN-116840360-A Method for detecting unbound bilirubin concentration and typing in trace blood by using high performance liquid chromatograph 吉林大学 2023-10-03 CN disclosed