SCHEMBL12725050

SCHEMBL12725050

CN(C)c1ccc(/N=N/c2scc[n+]2CC(=O)NC2CCSC2=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37

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
SCHEMBL12725055 0.88 POLB (0.37) POLBUSP2
SCHEMBL12725051 0.88 POLB (0.41) POLBUSP2
SCHEMBL13043620 0.75 MAPK1 (0.37) POLB
SCHEMBL13208380 0.70 ALDH1A1 (0.45) POLB
SCHEMBL17399825 0.70 USP2 (0.40) POLBUSP2CYP1A2
SCHEMBL13043394 0.66 INSR (0.41) POLB
SCHEMBL2197114 0.66 INSR (0.44) POLB
SCHEMBL12725056 0.66 POLB (0.35) POLBUSP2CYP1A2
SCHEMBL12380601 0.65 ALDH1A1 (0.50) POLB
SCHEMBL10061194 0.65 INSR (0.43) POLB

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
US-7931696-B2 Cationic dyes BASF SE Ludwigshafen (DE) 2011-04-26 — — US disclosed
US-20100058545-A1 CATIONIC DYES CIBA CORPORATION (US) 2010-03-11 — — 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-20100058545-A1 CATIONIC DYES CBR1, NR0B1, NDUFA5 POLB 2748/4885USP2 4731/4885CYP1A2 117/4885

“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.

Send feedback