SCHEMBL28871192

SCHEMBL28871192

NC(CO)CCCCCCCCCCCCCCO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.37
CYP2D6 P10635 2/20 0.37
SPHK1 Q9NYA1 1/20 0.37
GMNN O75496 1/20 0.37
POLB P06746 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 1/20 0.37
BLM P54132 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CETP P11597 1/20 0.37
HTT P42858 1/20 0.37
UBE2N P61088 1/20 0.37
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL1131550 1.00 LMNA (0.37) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL1131594 1.00 LMNA (0.37) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL1132545 1.00 LMNA (0.37) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL8358187 1.00 LMNA (0.37) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL1132232 0.97
SCHEMBL16393049 0.97
SCHEMBL8040300 0.97
SCHEMBL1132609 0.88
SCHEMBL8668914 0.88
SCHEMBL1603970 0.88

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-109481700-A A kind of molecular probe and preparation method thereof for hepatocarcinoma early diagnosis 广州贝奥吉因生物科技有限公司 2019-03-19 CN claimed