SCHEMBL9219277

SCHEMBL9219277

CC(CCO)OCC(O)CO

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
USP2 O75604 1/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
CYP1A2 P05177 3/20 0.32
KDM4E B2RXH2 3/20 0.32
AGTR1 P30556 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
DUSP3 P51452 1/20 0.32
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL6014346 0.85 THRB (0.46) THRBUSP2LMNAALDH1A1CYP1A2
SCHEMBL632454 0.84 USP2 (0.42) THRBUSP2LMNAALDH1A1TDP1
SCHEMBL19680485 0.84 TDP1 (0.35) THRBTDP1TSHR
SCHEMBL4440314 0.83 LMNA (0.40) THRBUSP2LMNAALDH1A1TDP1
SCHEMBL5273525 0.81 TDP1 (0.48) THRBLMNATDP1TSHRMAPK1
SCHEMBL21177829 0.81 USP2 (0.48) USP2LMNAALDH1A1TDP1CYP1A2
SCHEMBL14321545 0.79 USP2 (0.52) USP2LMNACYP1A2KDM4EMEN1
SCHEMBL3902429 0.79 TDP1 (0.38) THRBUSP2LMNAALDH1A1TDP1
SCHEMBL3433696 0.79 USP2 (0.41) THRBUSP2LMNAALDH1A1TDP1
SCHEMBL3899149 0.79 TDP1 (0.38) THRBUSP2LMNAALDH1A1TDP1

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
WO-1995005154-A1 CLEANSING COMPOSITION UNILEVER PLC (GB) 1995-02-23 WO disclosed
EP-0280579-B1 LOW PHOSPHORUS/LOW ZINC LUBRICANTS EXXON CHEMICAL PATENTS INC. (US) 1992-11-11 EP disclosed
EP-0280579-A2 Low phosphorus/low zinc lubricants EXXON CHEMICAL PATENTS INC. (US) 1988-08-31 EP disclosed