SCHEMBL9491360

SCHEMBL9491360

C=C(C)CN1C(=O)C(CO)SC1=NN=C1SCC(=O)N1C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ GAA P10253 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ATM Q13315 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL9491356 1.00 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494847 0.89 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494852 0.89 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL10878445 0.86 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL10878440 0.86 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9492368 0.86 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9492364 0.86 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494802 0.81 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494800 0.81 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AGAATSHR
Phosphoric Acid SCHEMBL10880246 0.81 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0494047-A1 Use of carbazones for the treatment of rheumatoid diseases CIBA-GEIGY AG (CH) 1992-07-08 — — EP claimed
US-5177091-A Rheumatic disorders CIBA-GEIGY CORPORATION (US) 1993-01-05 — — US disclosed
EP-0494047-A1 Use of carbazones for the treatment of rheumatoid diseases CIBA-GEIGY AG (CH) 1992-07-08 — — EP disclosed
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