SCHEMBL1414957

SCHEMBL1414957

CC1(C)CCCC(c2cc[c]cc2)(c2cc[c]cc2)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.32
ESR2 Q92731 3/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL18043790 0.82 ESR1 (0.52) ESR1ESR2
SCHEMBL1414959 0.80 OPRM1 (0.46)
SCHEMBL28749741 0.78 JAK2 (0.31)
SCHEMBL669016 0.77 ESR2 (0.61) ESR1ESR2ALDH1A1L3MBTL1
SCHEMBL307621 0.74 ESR1 (0.54) ESR1ESR2ALDH1A1L3MBTL1
SCHEMBL8058589 0.74 OPRM1 (0.48) ESR1ESR2ALDH1A1L3MBTL1
SCHEMBL28873897 0.73
SCHEMBL13760082 0.72 ESR1 (0.53) ESR1ESR2L3MBTL1
SCHEMBL12474042 0.71 ESR2 (0.69) ESR1ESR2ALDH1A1L3MBTL1
SCHEMBL1414961 0.70 ESR1 (0.65) ESR1ESR2ALDH1A1

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
EP-2205436-B1 METHOD FOR PRODUCING A POLYCARBONATE LAYERED COMPOSITE BUNDESDRUCKEREI GMBH (DE) 2011-04-20 EP claimed
EP-2205437-B1 METHOD FOR PRODUCING A POLYCARBONATE LAYERED COMPOSITE BUNDESDRUCKEREI GMBH (DE) 2011-04-13 EP claimed
EP-2205686-B1 METHOD FOR THE PRODUCTION OF A POLYCARBONATE LAMINATE BUNDESDRUCKEREI GMBH (DE) 2011-03-16 EP claimed