SCHEMBL12533232

SCHEMBL12533232

CC(C)(C)c1ccc(OP(=O)(Oc2ccccc2)Oc2ccc(C(C)(C)C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.39
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
SRC P12931 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
CASP3 P42574 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 6/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PLA2G1B P04054 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35

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
SCHEMBL30611835 1.00 APEX1 (0.39) APEX1CYP3A4TSHRSRCCA1
SCHEMBL1552049 1.00 APEX1 (0.39) APEX1CYP3A4TSHRSRCCA1
SCHEMBL12533235 0.93 CYP3A4 (0.41) APEX1CYP3A4TSHRL3MBTL1NPSR1
SCHEMBL16859696 0.92 CYP3A4 (0.43) APEX1CYP3A4TSHRCA1CA2
SCHEMBL16859697 0.91 APEX1 (0.37) APEX1CYP3A4TSHRCA1CA2
SCHEMBL82774 0.89 CA1 (0.42) APEX1CA1CA2CA9RAB9A
SCHEMBL29355190 0.89 CA1 (0.42) APEX1CA1CA2CA9RAB9A
SCHEMBL25933559 0.88 CYP3A4 (0.42) CYP3A4TSHRSRCL3MBTL1NPSR1
SCHEMBL13223751 0.88 APEX1 (0.41) APEX1CA1CA2CA9RAB9A
SCHEMBL1012736 0.86 CYP3A4 (0.38) APEX1CYP3A4CA1CA2CA9

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-7956111-B2 Non-halogen flameproof polycarbonate resin composition CHEIL INDUSTRIES, INC. (KR) 2011-06-07 US disclosed
US-20100152345-A1 Non-Halogen Flameproof Polycarbonate Resin Composition CHEIL INDUSTRIES INC. (KR) 2010-06-17 US disclosed