SCHEMBL28101008

SCHEMBL28101008

COc1ccc(P(=O)(Oc2ccccc2)Oc2ccccc2)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA4 P22748 3/20 0.41
▸ CA5A P35218 3/20 0.41
▸ CA7 P43166 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ CA5B Q9Y2D0 3/20 0.41
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ OXTR P30559 3/20 0.39
▸ AVPR1A P37288 2/20 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
SCHEMBL28101003 0.76 TDP1 (0.70) L3MBTL1TDP1CA12CA1CA2
SCHEMBL28100899 0.74 L3MBTL1 (0.51) L3MBTL1TDP1CA12CA1CA2
SCHEMBL28101005 0.73 NNMT (0.49) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL561190 0.71 L3MBTL1 (1.00) L3MBTL1TDP1KMT2AMEN1CA12
SCHEMBL385365 0.71 L3MBTL1 (0.73) L3MBTL1TDP1KMT2AMEN1CA12
SCHEMBL29034878 0.71 TDP1 (0.73) L3MBTL1TDP1CA12CA1CA2
SCHEMBL8909182 0.70 L3MBTL1 (0.66) L3MBTL1TDP1KMT2AMEN1CA12
SCHEMBL14566904 0.70 L3MBTL1 (0.79) L3MBTL1TDP1KMT2AMEN1CA12
SCHEMBL28100916 0.69 L3MBTL1 (0.64) L3MBTL1TDP1KMT2AMEN1CA12
SCHEMBL976099 0.69 L3MBTL1 (0.76) L3MBTL1TDP1KMT2AMEN1CA12

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
CN-105968136-B A kind of preparation method of fragrance phosphonate compound 北京大学 2018-12-07 — — CN disclosed
CN-105968136-A Preparation method of aromatic phosphonate compound 北京大学 2016-09-28 — — CN disclosed
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