SCHEMBL11064101

SCHEMBL11064101

CC(C)(C)c1ccc(OP(O)c2ccccc2-c2ccc(C(C)(C)C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PLA2G1B P04054 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
APEX1 P27695 1/20 0.37
TRPV1 Q8NER1 1/20 0.32
DNMT1 P26358 3/20 0.32
KIF11 P52732 1/20 0.31
NR1H4 Q96RI1 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL4147317 0.88 APEX1 (0.36) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL11486450 0.86 NPC1 (0.37) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL4151776 0.84 ALDH1A1 (0.35) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL6742007 0.82 NPC1 (0.39) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL11494047 0.81 NPC1 (0.33) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL11569511 0.79 ALDH1A1 (0.42) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL29026606 0.78 APEX1 (0.35) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL29444201 0.78 APEX1 (0.35) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL30402913 0.78 APEX1 (0.35) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL28451316 0.78 ALDH1A1 (0.41) 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
US-4474914-A Ortho-alkylated phenyl phosphonites and stabilized organic compositions CIBA-GEIGY CORPORATION (US) 1984-10-02 US claimed
US-4406842-A PHOTOSTABILITY FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1983-09-27 US claimed
US-4474914-A Ortho-alkylated phenyl phosphonites and stabilized organic compositions CIBA-GEIGY CORPORATION (US) 1984-10-02 US disclosed
US-4406842-A PHOTOSTABILITY FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1983-09-27 US disclosed