SCHEMBL15929641

SCHEMBL15929641

COc1cc(C(C)(C)c2ccc(O)c(C)c2)ccc1C

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.69
ESR2 Q92731 7/20 0.46
AR P10275 3/20 0.46
KLF10 Q13118 1/20 0.43
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
RORC P51449 1/20 0.40
MAOB P27338 1/20 0.40
TP53 P04637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TUBB1 Q9H4B7 1/20 0.38
CYP19A1 P11511 1/20 0.38

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
SCHEMBL17049744 0.93 ESR1 (0.58) ESR1KLF10ALOX15ALOX12MAOB
SCHEMBL18467873 0.88 ESR1 (0.71) ESR1ESR2ARKLF10ALOX15
SCHEMBL29431900 0.83 MAOB (0.57) ESR1KLF10ALOX15ALOX12RORC
SCHEMBL29445694 0.83 MAOB (0.57) ESR1KLF10ALOX15ALOX12RORC
SCHEMBL125447 0.83 MAOB (0.57) ESR1KLF10ALOX15ALOX12RORC
SCHEMBL29350788 0.83 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL35285 0.83 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL29360146 0.83 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL15929636 0.82 ESR1 (0.44) ESR1ESR2ARMAOBTP53
SCHEMBL13609956 0.82 ESR1 (0.55) ESR1ESR2ARKLF10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9035287-B2 Polymeric materials for use in metal-oxide-semiconductor field-effect transistors POLYERA CORPORATION (US) 2015-05-19 US disclosed
US-20140217395-A1 Polymeric Materials for Use in Metal-Oxide-Semiconductor Field-Effect Transistors POLYERA CORPORATION (US) 2014-08-07 US disclosed