SCHEMBL29113254

SCHEMBL29113254

O=P(OCOCc1ccccc1)(Oc1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ CA12 O43570 8/20 0.45
▸ CA1 P00915 8/20 0.45
▸ CA2 P00918 8/20 0.45
▸ CA4 P22748 8/20 0.45
▸ CA5A P35218 8/20 0.45
▸ CA7 P43166 8/20 0.45
▸ CA9 Q16790 8/20 0.45
▸ CA5B Q9Y2D0 8/20 0.45
▸ TSHR P16473 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ELANE P08246 1/20 0.40
▸ PRTN3 P24158 1/20 0.40
▸ SRC P12931 1/20 0.38
▸ ANPEP P15144 1/20 0.38
▸ LAP3 P28838 1/20 0.38

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
SCHEMBL28960451 0.78 MEN1 (0.50) L3MBTL1CA2TSHRMEN1KMT2A
SCHEMBL561190 0.75 L3MBTL1 (1.00) L3MBTL1TDP1CA12CA1CA2
SCHEMBL10634585 0.75 L3MBTL1 (0.68) L3MBTL1TDP1CA12CA1CA2
SCHEMBL11128694 0.75 CA12 (0.70) L3MBTL1TDP1CA12CA1CA2
SCHEMBL5400948 0.74 TSHR (0.61) L3MBTL1TDP1CA2TSHRMEN1
(Chloromethyl)Benzene SCHEMBL3260170 0.73 L3MBTL1 (0.71) L3MBTL1TDP1CA12CA1CA2
SCHEMBL4159187 0.72 TDP1 (0.63) L3MBTL1TDP1CA12CA1CA2
SCHEMBL20710851 0.72 L3MBTL1 (0.63) L3MBTL1TDP1CA12CA1CA2
SCHEMBL4150024 0.72 LMNA (0.59) L3MBTL1TDP1HTTELANEPRTN3
SCHEMBL11546381 0.72 TDP1 (0.53) L3MBTL1TDP1CA12CA1CA2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114409706-B Preparation method of phenyl hydrogen phosphonate and intermediate thereof 上海医药工业研究院 2023-11-28 — — CN disclosed
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