SCHEMBL9493057

SCHEMBL9493057

C=C1SC(=NN=C2SCC(=O)N2C)N(CC=CC)C1=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GAA P10253 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ GSK3A P49840 1/20 0.30
▸ GSK3B P49841 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
SCHEMBL9494860 0.87 LMNA (0.41) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494856 0.87 LMNA (0.41) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9493049 0.79 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9493054 0.79 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494274 0.72 LMNA (0.52) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494278 0.72 LMNA (0.52) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL17813824 0.67 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AGAATSHR
Phosphoric Acid SCHEMBL11090384 0.66 LMNA (0.49) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494802 0.65 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AGAATSHR
SCHEMBL9494800 0.65 ALDH1A1 (0.41) 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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