SCHEMBL16997494

SCHEMBL16997494

O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc(Sc2ccc(OP(=O)(Oc3ccccc3)Oc3ccccc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
SRC P12931 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.42
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
STS P08842 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA5B Q9Y2D0 1/20 0.39

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
SCHEMBL131239 0.87 CYP3A4 (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
SCHEMBL10015245 0.87 CYP3A4 (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
SCHEMBL10015247 0.87 CYP3A4 (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL28557783 0.84 SRC (0.64) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL483692 0.84 SRC (0.64) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL28761613 0.84 SRC (0.64) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL18116 0.84 SRC (0.64) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL2530073 0.82 SRC (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL7746390 0.82 SRC (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
Triphenyl Phosphate SCHEMBL1028391 0.82 SRC (0.61) CYP3A4TSHRSRCL3MBTL1TDP1

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
CN-112292426-B Polyphosphoric acid amine salt composition, polyphosphoric acid amine salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2023-06-23 CN disclosed
CN-112272687-B Phosphate amine salt composition, phosphate amine salt flame retardant composition, flame-retardant synthetic resin composition containing same, and molded article thereof 株式会社ADEKA 2022-06-10 CN disclosed
CN-113966359-A Additive composition 株式会社艾迪科 2022-01-21 CN disclosed
US-9834884-B2 Aqueous dispersion of polyurethane resin, flame-retardant polyester fiber using the same, and method for producing said fiber ADEKA CORPORATION (JP) 2017-12-05 US disclosed
US-20150225893-A1 AQUEOUS DISPERSION OF POLYURETHANE RESIN, FLAME-RETARDANT POLYESTER FIBER USING THE SAME, AND METHOD FOR PRODUCING SAID FIBER ADEKA CORPORATION (JP) 2015-08-13 US disclosed