SCHEMBL27561102

SCHEMBL27561102

OCC(O)COC(O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
ALDH1A1 P00352 1/20 0.42
USP2 O75604 1/20 0.35
THRB P10828 1/20 0.35
CYP1A2 P05177 3/20 0.32
KDM4E B2RXH2 3/20 0.32
AGTR1 P30556 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
DUSP3 P51452 1/20 0.31
AR P10275 1/20 0.31
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
SCHEMBL6034519 0.79 LMNA (0.38) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL5249327 0.76 LMNA (0.40) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL8083397 0.76 MAPK1 (0.56) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL116799 0.76 MAPK1 (0.56) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL2155545 0.76 LMNA (0.40) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL12083370 0.76 MAPK1 (0.56) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL27902633 0.76 LMNA (0.40) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL6269634 0.76 LMNA (0.40) LMNAALDH1A1USP2THRBCYP1A2
SCHEMBL11005958 0.75 USP2 (0.39) LMNAALDH1A1USP2CYP1A2KDM4E
SCHEMBL8825289 0.75 ALDH1A1 (0.35) LMNAALDH1A1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101711269-B Anticorrosive paint BASF SE 2013-05-15 CN disclosed
CN-101111571-B Anti-corrosion coatings containing thioamide groups BASF AG 2011-07-06 CN disclosed
CN-102083916-A Aqueous suspensions of fine-particle fillers, method for the production thereof and use thereof for producing fluid-containing papers BASF SE 2011-06-01 CN disclosed
CN-101711269-A Anticorrosive paint BASF SE 2010-05-19 CN disclosed
CN-101111571-A Anti-corrosion coatings containing thioamide groups BASF AG (DE) 2008-01-23 CN disclosed
CN-1198849-C Method for prodn. of shaped hydrogel of absorbent resin NIPPON CATALYTIC CHEM IND (JP) 2005-04-27 CN disclosed
CN-1340084-A Polyorganosiloxane RTV compositions DOW CORNING (US) 2002-03-13 CN disclosed
CN-1233617-A Method for prodn. of shaped hydrogel of absorbent resin NIPPON CATALYTIC CHEM IND (JP) 1999-11-03 CN disclosed