SCHEMBL4639508

SCHEMBL4639508

NS(=O)(=O)c1ccc(NN=Cc2c[nH]c3ccccc23)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.73
▸ CA1 P00915 1/20 0.73
▸ CA2 P00918 1/20 0.73
▸ CA9 Q16790 1/20 0.73
▸ SENP7 Q9BQF6 8/20 0.69
▸ GAA P10253 10/20 0.67
▸ MAPT P10636 9/20 0.67
▸ MEN1 O00255 8/20 0.67
▸ KMT2A Q03164 8/20 0.67
▸ SENP8 Q96LD8 6/20 0.67
▸ SENP6 Q9GZR1 6/20 0.67
▸ CASP3 P42574 4/20 0.67
▸ PSMD14 O00487 1/20 0.67
▸ TLR9 Q9NR96 1/20 0.67
▸ KLF5 Q13887 1/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ NPC1 O15118 4/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ TDP1 Q9NUW8 4/20 0.55
▸ HTT P42858 2/20 0.54

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
SCHEMBL4639506 1.00 CA12 (0.73) CA12CA1CA2CA9SENP7
SCHEMBL27139059 0.82 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL24629300 0.82 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL24629299 0.80 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL27126553 0.80 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL27123871 0.80 MEN1 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL26983136 0.80 MEN1 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL24629301 0.79 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL27127002 0.79 SENP7 (1.00) SENP7GAAMAPTMEN1KMT2A
SCHEMBL24629292 0.73 GAA (0.75) CA12CA1CA2CA9SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1476149-B1 SUBSTITUTED HYDRAZONES AS INHIBITORS OF CYCLOOXYGENASE-2 UNIV TEMPLE (US) 2008-08-06 — — EP disclosed
EP-1476149-A4 SUBSTITUTED HYDRAZONES AS INHIBITORS OF CYCLOOXYGENASE-2 UNIV TEMPLE (US) 2005-09-14 — — EP disclosed
EP-1476149-A2 SUBSTITUTED HYDRAZONES AS INHIBITORS OF CYCLOOXYGENASE-2 Temple University of the Commonwealth System of Higher Education (US) 2004-11-17 — — EP disclosed
WO-2003049698-A2 SUBSTITUTED HYDRAZONES AS INHIBITORS OF CYCLOOXYGENASE-2 TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2003-06-19 — — WO disclosed
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