SCHEMBL972122

SCHEMBL972122

Cc1cc(/C=N/O)n(C)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ HTT P42858 4/20 0.36
▸ ALOX15 P16050 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ HPGD P15428 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
SCHEMBL972124 1.00 POLB (0.38) POLBCYP2C19SMN1; SMN2HTTALOX15
SCHEMBL17012075 0.82 SMN1; SMN2 (0.34) SMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL17796355 0.78 POLB (0.37) POLBCYP2C19SMN1; SMN2HTTKDM4E
SCHEMBL17796356 0.78 POLB (0.37) POLBCYP2C19SMN1; SMN2HTTKDM4E
SCHEMBL4796095 0.77 — —
SCHEMBL17796722 0.75 ALDH1A1 (0.34) POLBCYP2C19SMN1; SMN2HTTALOX15
SCHEMBL17796721 0.75 ALDH1A1 (0.34) POLBCYP2C19SMN1; SMN2HTTALOX15
SCHEMBL894594 0.72 — —
SCHEMBL20049234 0.72 — —
SCHEMBL8043524 0.72 — —

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
US-20110015065-A1 Substituted Sulfonic Acid Amide Compounds BASF SE (DE) 2011-01-20 — — US disclosed
EP-2252590-A1 SUBSTITUTED SULFONIC ACID AMIDE COMPOUNDS BASF SE (DE) 2010-11-24 — — EP disclosed
WO-2009101082-A1 SUBSTITUTED SULFONIC ACID AMIDE COMPOUNDS BASF SE (DE) 2009-08-20 — — WO 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-20110015065-A1 Substituted Sulfonic Acid Amide Compounds STS, NAPA, NAAA POLB 4080/4885CYP2C19 1637/4885SMN1; SMN2 3963/4885

“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.

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