SCHEMBL8776573

SCHEMBL8776573

[N]=Nc1c(S(=O)(=O)O)c(O)c(N)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAPK1 P53355 1/20 0.44
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ APP P05067 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SNCA P37840 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MPL P40238 5/20 0.38
▸ SENP2 Q9HC62 4/20 0.38
▸ SENP1 Q9P0U3 4/20 0.38
▸ SUMO2 P61956 3/20 0.38
▸ SUMO1 P63165 3/20 0.38
▸ SENP7 Q9BQF6 3/20 0.38
▸ CYP2D6 P10635 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
SCHEMBL8776569 0.88 MPL (0.41) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL8915189 0.80 DAPK1 (0.51) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL8025326 0.80 DAPK1 (0.56) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL5734148 0.76 DAPK1 (0.51) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL8776617 0.75 AURKA (0.42) DAPK1ALDH1A1MPLSENP2SENP1
SCHEMBL155814 0.73 DAPK1 (0.47) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL9770459 0.72 SUMO2 (0.50) MEN1ALDH1A1APPMAPTTHRB
SCHEMBL28996760 0.71 DAPK1 (0.49) DAPK1MEN1ALDH1A1APPMAPT
SCHEMBL11532003 0.70 MPL (0.47) MEN1ALDH1A1MAPTTHRBKMT2A
SCHEMBL23787571 0.70 APP (0.59) MEN1ALDH1A1APPMAPTTHRB

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-0810265-A1 Substantive stilbene azo dyestuffs BAYER AG (DE) 1997-12-03 — — EP disclosed
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