SCHEMBL6139230

SCHEMBL6139230

COC(=O)[C@H](OS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 1/20 0.43
▸ PSEN2 P49810 1/20 0.43
▸ APH1B Q8WW43 1/20 0.43
▸ NCSTN Q92542 1/20 0.43
▸ APH1A Q96BI3 1/20 0.43
▸ PSENEN Q9NZ42 1/20 0.43
▸ FLT1 P17948 3/20 0.41
▸ FLT4 P35916 3/20 0.41
▸ KDR P35968 3/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ABCB11 O95342 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ RECQL P46063 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ F2 P00734 1/20 0.37
▸ PRSS1 P07477 1/20 0.37

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
SCHEMBL28824902 1.00 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2169427 0.92 ABCB11 (0.39) MEN1KMT2AABCB11ALDH1A1LMNA
SCHEMBL28560399 0.92 ABCB11 (0.39) MEN1KMT2AABCB11ALDH1A1LMNA
SCHEMBL26301826 0.92 ABCB11 (0.39) MEN1KMT2AABCB11ALDH1A1LMNA
SCHEMBL28555501 0.91 LMNA (0.42) MEN1KMT2AABCB11ALDH1A1LMNA
SCHEMBL28566525 0.90 GCKR (0.44) FLT1FLT4KDRKMT2AALDH1A1
SCHEMBL14141639 0.87 KMT2A (0.44) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL29993001 0.87 KMT2A (0.44) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL23524 0.87 KMT2A (0.44) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL7490542 0.85 TDP1 (0.43) FLT1FLT4KDRMEN1KMT2A

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
US-6894186-B2 Hydroxyacetic ester derivatives, preparation method and use as synthesis intermediates SANOFI-SYNTHELABO (FR) 2005-05-17 — — US claimed
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