SCHEMBL14619463

SCHEMBL14619463

COc1ccc(S(=O)(=O)CCC(=O)NOCc2ccc(OCc3ccc(C)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.63
▸ MMP1 P03956 1/20 0.56
▸ KMT2A Q03164 5/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ POLB P06746 3/20 0.53
▸ GRK2 P25098 1/20 0.53
▸ HTT P42858 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ EGFR P00533 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL7862209 0.85 MMP1 (0.62) ALDH1A1MMP1KMT2AMEN1POLB
SCHEMBL14619087 0.84 KMT2A (0.62) ALDH1A1KMT2AMEN1POLBHTT
SCHEMBL14619461 0.75 MEN1 (0.57) ALDH1A1KMT2AMEN1
SCHEMBL5602773 0.73 MMP1 (1.00) ALDH1A1MMP1KMT2AMEN1POLB
SCHEMBL12407772 0.72 BCHE (0.56) ALDH1A1POLB
SCHEMBL87194 0.72 BCHE (0.56) ALDH1A1POLB
SCHEMBL18475585 0.72 APP (0.69) ALDH1A1POLB
SCHEMBL171857 0.72 APP (0.69) ALDH1A1POLB
SCHEMBL14619239 0.71 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1EGFR
SCHEMBL10796915 0.71 ALDH1A1 (0.65) ALDH1A1MMP1KMT2AMEN1HTT

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
EP-0946478-B1 PROCESS FOR THE SOLID PHASE SYNTHESIS OF ALDEHYDES, KETONES AND HYDROXAMIC ACID COMPOUNDS AVENTIS PHARMA INC (US) 2007-02-14 — — EP disclosed
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