SCHEMBL8174040

SCHEMBL8174040

Cc1ccc(O)c(C=C2SC(=S)NC2=O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 2/20 0.71
▸ NAT1 P18440 5/20 0.66
▸ GSK3B P49841 2/20 0.62
▸ MYC P01106 1/20 0.60
▸ MAX P61244 1/20 0.60
▸ CISD1 Q9NZ45 3/20 0.57
▸ MAOB P27338 2/20 0.57
▸ MEN1 O00255 4/20 0.57
▸ POLB P06746 4/20 0.57
▸ MAPT P10636 4/20 0.57
▸ KMT2A Q03164 4/20 0.57
▸ RECQL P46063 3/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ GAA P10253 2/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ PSMD14 O00487 2/20 0.57
▸ MMP2 P08253 2/20 0.57
▸ ALPL P05186 1/20 0.57
▸ ALPI P09923 1/20 0.57
▸ ALPG P10696 1/20 0.57

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
SCHEMBL8174037 1.00 PTP4A3 (0.71) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL18102943 0.86 PTP4A3 (0.75) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL3405860 0.83 PTP4A3 (0.71) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL18102858 0.83 PTP4A3 (0.75) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL13616173 0.83 PTP4A3 (0.71) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL14464055 0.83 PTP4A3 (0.71) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL3405858 0.83 PTP4A3 (0.71) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL14464056 0.83 PTP4A3 (1.00) PTP4A3NAT1GSK3BMYCMAX
SCHEMBL14226382 0.83 NAT1 (0.69) PTP4A3NAT1GSK3BMEN1POLB
SCHEMBL19659989 0.83 CA2 (0.71) PTP4A3NAT1GSK3BMYCMAX

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
WO-2000018748-A1 RHODANINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS ROCHE DIAGNOSTICS GMBH (DE) 2000-04-06 — — WO disclosed
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