SCHEMBL6742007

SCHEMBL6742007

CC(C)(C)c1ccc(OP(Oc2ccc(C(C)(C)C)cc2C(C)(C)C)c2ccccc2-c2ccccc2P(Oc2ccc(C(C)(C)C)cc2C(C)(C)C)Oc2ccc(C(C)(C)C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 2/20 0.39
PLA2G1B P04054 1/20 0.39
NFKB1 P19838 1/20 0.39
CASP3 P42574 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
APEX1 P27695 1/20 0.38
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ERBB2 P04626 1/20 0.32
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 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
SCHEMBL29520649 0.92 ALDH1A1 (0.36) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL5888063 0.92 ALDH1A1 (0.36) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL10778908 0.89 NPC1 (0.36) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL6742012 0.84 APEX1 (0.33) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL2187400 0.84 CA1 (0.37) ALDH1A1APEX1CA1CA2CA9
SCHEMBL9299327 0.83 MAPK14 (0.42) ALDH1A1APEX1CA1CA2CA9
SCHEMBL11064101 0.82 NPC1 (0.38) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL30599590 0.82 NPC1 (0.35) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL5176952 0.82 NPC1 (0.35) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL31556870 0.81 APEX1 (0.39) NPC1RAB9AALDH1A1PLA2G1BNFKB1

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
US-6790914-B2 TRANSPARENT (CROSSLINKED) RESIN FILM CAN BE USED AS A POLARIZING FILM, SURFACE PROTECTIVE FILM, RETARDATION FILM, TRANSPARENT CONDUCTIVE FILM, LIGHT DIFFUSION FILM, FILM FOR AN EL DISPLAY DEVICE, TRANSPARENT CONDUCTIVE COMPOSITE MATERIAL, JSR CORPORATION (JP) 2004-09-14 US disclosed
US-20040106740-A1 Resin film and applications thereof JSR CORPORATION (JP) 2004-06-03 US disclosed
EP-1195397-B1 Composition of cyclic olefin addition copolymer and cross-linked material JSR CORP (JP) 2004-04-14 EP disclosed
US-20020042461-A1 Composition of cyclic olefin addition copolymer and cross-linked material JSR CORPORATION (JP) 2002-04-11 US disclosed
EP-1195397-A1 Composition of cyclic olefin addition copolymer and cross-linked material JSR Corporation (JP) 2002-04-10 EP disclosed