SCHEMBL6249798

SCHEMBL6249798

OCC(O)COCC(O)CO.[MgH2]

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KDM4E B2RXH2 4/20 0.40
THRB P10828 1/20 0.40
CYP1A2 P05177 3/20 0.35
AGTR1 P30556 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
DUSP3 P51452 1/20 0.34
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL28081523 0.97 USP2 (0.48) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL1638881 0.97 LMNA (0.53) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL30754 0.97 LMNA (0.53) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL15894238 0.93 LMNA (0.50) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL10329835 0.93 LMNA (0.50) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL25238278 0.93 LMNA (0.50) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL821029 0.93 LMNA (0.50) LMNAUSP2ALDH1A1KDM4ETHRB
SCHEMBL22279336 0.93 LMNA (0.50) LMNAUSP2ALDH1A1KDM4ETHRB
Glycerin SCHEMBL2582537 0.93 LMNA (0.60) LMNAUSP2ALDH1A1KDM4ETHRB
Glycerin SCHEMBL314170 0.93 LMNA (0.60) LMNAUSP2ALDH1A1KDM4ETHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0969804-B1 PROCESS FOR PREPARING SILICONE ELASTOMER COMPOSITIONS UNILEVER PLC (GB) 2005-08-24 EP disclosed
EP-0969804-A1 PROCESS FOR PREPARING SILICONE ELASTOMER COMPOSITIONS UNILEVER PLC (GB) 2000-01-12 EP disclosed
US-5854336-A Process for preparing silicone elastomer compositions CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1998-12-29 US disclosed
WO-1998042307-A1 PROCESS FOR PREPARING SILICONE ELASTOMER COMPOSITIONS UNILEVER PLC (GB) 1998-10-01 WO disclosed