SCHEMBL27982017

SCHEMBL27982017

CC(C)(C)c1ccc(-c2ccc(OP=O)c(-c3ccc(C(C)(C)C)cc3C(C)(C)C)c2-c2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PLA2G1B P04054 1/20 0.36
NFKB1 P19838 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
APEX1 P27695 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPK14 Q16539 1/20 0.31
RXRA P19793 1/20 0.30

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
SCHEMBL28325658 0.95 NPC1 (0.36) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL27981705 0.91 NPC1 (0.37) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL27998066 0.90 NPC1 (0.39) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL27998069 0.85 NPC1 (0.39) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL20451503 0.85 NPC1 (0.35) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL27744091 0.84 RXRA (0.39) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL30297025 0.82 APEX1 (0.33) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL500587 0.82 APEX1 (0.33) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL34468483 0.82 NPC1 (0.34) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL7798861 0.80 NPC1 (0.46) NPC1ALDH1A1PLA2G1BNFKB1CASP3

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
CN-110256661-A The manufacturing method of thermoplastic resin 三菱瓦斯化学株式会社 2019-09-20 CN disclosed
CN-110105558-A The manufacturing method of thermoplastic resin 三菱瓦斯化学株式会社 2019-08-09 CN disclosed
CN-109071789-A Copolycarbonate, using its optical lens and film and the copolymer manufacturing method 三菱瓦斯化学株式会社 2018-12-21 CN disclosed
CN-102712802-B Polylactic acid composition TEIJIN LTD 2014-09-24 CN disclosed