SCHEMBL9564404

SCHEMBL9564404

CC(Nc1ccno1)c1cccs1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ EGFR P00533 2/20 0.41
▸ IDH1 O75874 2/20 0.39
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.34
▸ TAAR1 Q96RJ0 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL10484390 0.70 ALOX5 (0.43) MEN1KMT2AEGFRMAPTALDH1A1
SCHEMBL15598917 0.70 — —
SCHEMBL553460 0.69 — —
SCHEMBL1488680 0.67 — —
SCHEMBL105608 0.67 ALOX5 (0.41) MEN1KMT2AEGFRMAPTALDH1A1
Oxalic Acid SCHEMBL11112449 0.67 TDP1 (0.44) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL13138026 0.65 TDP1 (0.45) MEN1KMT2AEGFRMAPTALDH1A1
SCHEMBL15003945 0.65 ALDH1A1 (0.57) MEN1KMT2AEGFRMAPTALDH1A1
SCHEMBL1309059 0.64 — —
SCHEMBL2030838 0.64 ALOX5 (0.47) MEN1KMT2AMAPTALDH1A1POLB

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-0563686-A1 Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation BAYER AG (DE) 1993-10-06 — — EP disclosed
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