SCHEMBL5283509

SCHEMBL5283509

Cc1ccsc1COS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
ADRA1D P25100 2/20 0.36
RIPK1 Q13546 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.35
KDM6B O15054 1/20 0.35
KDM4A O75164 1/20 0.35
KDM5C P41229 1/20 0.35
KDM4D Q6B0I6 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
PTGS2 P35354 1/20 0.34
GSK3B P49841 1/20 0.33
HSD11B1 P28845 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KEAP1 Q14145 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
SCHEMBL958565 0.74
SCHEMBL11888047 0.72
SCHEMBL2619612 0.72 ALOX5 (0.41) ALOX5ADRA1DRIPK1ALDH1A1KDM4E
SCHEMBL2242512 0.70 ALOX5 (0.47) ALOX5RIPK1ALDH1A1KDM4EKDM6B
SCHEMBL1367928 0.68 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL2209611 0.67 SLC22A12 (0.37) ALDH1A1KDM4EKEAP1
SCHEMBL709654 0.67 CYP1A2 (0.40) ALDH1A1PTGS2
SCHEMBL256017 0.66
SCHEMBL10445253 0.66
SCHEMBL4952656 0.66 CA2 (0.58) ALDH1A1KDM4ESMN1; SMN2PTGS2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 ALOX5 4479/4885ADRA1D 2563/4885RIPK1 4634/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.