SCHEMBL9494810

SCHEMBL9494810

C=CCN1C(=O)CSC1=[N+]([O-])N=C1N(C)C(=O)C[S+]1[O-]

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.32

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
SCHEMBL9491960 0.80 LMNA (0.43) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9491949 0.78 LMNA (0.44) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9491952 0.78 LMNA (0.44) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9492241 0.71 LMNA (0.39) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9492233 0.71 LMNA (0.39) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9494278 0.62 LMNA (0.52) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL9494274 0.62 LMNA (0.52) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL1692864 0.61 LMNA (0.49) RECQLLMNAALDH1A1MAPK1MEN1
Phosphoric Acid SCHEMBL11090384 0.60 LMNA (0.49) RECQLLMNAALDH1A1MAPK1MEN1
SCHEMBL181568 0.58 GSK3A (0.53) RECQLLMNAALDH1A1MAPK1MEN1

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
US-5177091-A Rheumatic disorders CIBA-GEIGY CORPORATION (US) 1993-01-05 — — US disclosed
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