SCHEMBL7324636

SCHEMBL7324636

COC(=O)c1cccc(OCC(=O)OC(C)(C)C)c1NS(=O)(=O)c1ccc(OC)cc1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
PKM P14618 1/20 0.38
PTPN1 P18031 1/20 0.38
MTNR1A P48039 2/20 0.38
MTNR1B P49286 1/20 0.38
SGMS1 Q86VZ5 1/20 0.38
HSP90AA1 P07900 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
LMNA P02545 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
SCHEMBL7323187 0.88 MTNR1A (0.48) MEN1KMT2AALDH1A1GAAMTNR1A
SCHEMBL7317223 0.86 GAA (0.41) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7324219 0.86 MEN1 (0.42) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7321536 0.85 MTNR1A (0.41) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7314673 0.84 MEN1 (0.48) MEN1KMT2AALDH1A1GAAMTNR1A
SCHEMBL7321080 0.84 MAPT (0.45) MEN1KMT2AGAAPKMMTNR1A
SCHEMBL7317547 0.83 MEN1 (0.42) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7323435 0.83 F2 (0.42) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7315938 0.83 MEN1 (0.41) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL7311595 0.83 LTA4H (0.42) MEN1KMT2AALDH1A1GAAPTPN1

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-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed