SCHEMBL29024409

SCHEMBL29024409

CCCCCCCCCCCCCCCCOC(CO)OCC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
DNM1 Q05193 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 2/20 0.40
LPAR1 Q92633 6/20 0.38
LPAR3 Q9UBY5 6/20 0.38
LPAR2 Q9HBW0 3/20 0.38
LPAR6 P43657 2/20 0.38
LPAR4 Q99677 2/20 0.38
LPAR5 Q9H1C0 2/20 0.38
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL8950367 1.00 USP2 (0.46) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL28164046 0.98 CNR1 (0.44) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL16829859 0.94 USP2 (0.50) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL29372863 0.94 USP2 (0.50) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL831869 0.91 TSHR (0.39) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL5591161 0.86 HTT (0.52) USP2ALDH1A1CNR1CNR2MEN1
SCHEMBL744018 0.86 USP2 (0.40) USP2DNM1ALDH1A1CNR1CNR2
SCHEMBL27835501 0.83 DNM1 (0.47) DNM1THRBLPAR1LPAR3LPAR2
SCHEMBL5013566 0.82 THRB (0.35) USP2ALDH1A1THRBLMNAHSD17B10
SCHEMBL10004744 0.80 DNM1 (0.43) DNM1ALDH1A1CNR1CNR2THRB

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-110655546-B Sofosbuvir derivative, and preparation method and application thereof 安徽贝克制药股份有限公司 2023-05-16 CN disclosed