SCHEMBL6671173

SCHEMBL6671173

Cc1cc(CCC(C)Cc2cc(C)c(O)c(C)c2)cc(C)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.46
PTGS2 P35354 4/20 0.46
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
NR3C2 P08235 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
SHBG P04278 1/20 0.36
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
HMGB1 P09429 1/20 0.34
CXCL12 P48061 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CISD1 Q9NZ45 1/20 0.33
ALOX5 P09917 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 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
SCHEMBL1517504 0.89 PTGS2 (0.43) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL27798204 0.85 NR3C1 (0.40) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL27819484 0.85 NR3C1 (0.40) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL4633834 0.82 PTGS1 (0.50) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL4633827 0.80 NR3C1 (0.45) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL27928023 0.80 PTGS1 (0.48) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL8186747 0.77 CA1 (0.46) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL10834423 0.77 PTGS1 (0.46) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL3801816 0.76 PTGS1 (0.68) PTGS1PTGS2NR3C1PGRNR3C2
SCHEMBL5609492 0.75 CA1 (0.44) PTGS1PTGS2NR3C1PGRNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110072918-A By the block copolycarbonate ester of compatilizer manufacture silicone-containing 科思创德国股份有限公司 2019-07-30 CN disclosed
CN-106164174-B Thermoplastic composition 三菱化学欧洲合资公司 2019-05-10 CN disclosed
CN-103946268-B Metallized multilayer articles made of specific polycarbonates having a low coefficient of thermal expansion 科思创德国股份有限公司 2019-02-22 CN disclosed
EP-3331935-A1 AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS Sika Technology AG (CH) 2018-06-13 EP disclosed
WO-2004035654-A1 METHOD FOR SEPARATING RESIDUAL MONOMERS AND OLIGOMER FROM POLYCARBONATE BAYER MATERIALSCIENCE AG (DE) 2004-04-29 WO disclosed