SCHEMBL3824558

SCHEMBL3824558

CC12OC1(OCC(O)CO)O2

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
LMNA P02545 3/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 2/20 0.32
KDM4E B2RXH2 2/20 0.32
AGTR1 P30556 1/20 0.32
DUSP3 P51452 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL1604260 0.68 TDP1 (0.43)
SCHEMBL1171533 0.67 ALDH1A1 (0.35) USP2LMNAALDH1A1
Methyl Alcohol SCHEMBL28875064 0.64
SCHEMBL19520622 0.64 ALDH1A1 (0.32) LMNAALDH1A1
SCHEMBL1883676 0.64 LMNA (0.36) USP2LMNAALDH1A1
SCHEMBL7401075 0.63
Ethane SCHEMBL2303498 0.63 USP2 (0.54) USP2LMNAALDH1A1CYP1A2KDM4E
SCHEMBL4290559 0.63
SCHEMBL28381881 0.63
Ethane SCHEMBL28093262 0.63 LMNA (0.47) USP2LMNAALDH1A1CYP1A2KDM4E

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
US-20090306257-A1 Stabilizer System for Halogenated Polymers CATENA ADDITIVES GMBH & CO. KG (DE) 2009-12-10 US disclosed