SCHEMBL13629464

SCHEMBL13629464

CCc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1C

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.77
NPSR1 Q6W5P4 1/20 0.77
SMN1; SMN2 Q16637 5/20 0.67
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
LMNA P02545 1/20 0.60
ALOX12 P18054 1/20 0.60
TP53 P04637 2/20 0.60
POLB P06746 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
ALPL P05186 3/20 0.57
HIF1A Q16665 1/20 0.55

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
SCHEMBL13853023 0.86 SMN1; SMN2 (0.66) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL13629773 0.85 ALDH1A1 (0.57) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL13615080 0.82 ALDH1A1 (0.77) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL18530465 0.82 SMN1; SMN2 (0.79) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL13629552 0.82 PKM (0.74) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL13629345 0.79 PGR (0.61) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7531220 0.78 TP53 (0.71) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL7529463 0.78 TP53 (0.80) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL5962533 0.78 SMN1; SMN2 (0.71) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL7535714 0.78 SMN1; SMN2 (0.72) ALDH1A1NPSR1SMN1; SMN2MEN1KMT2A

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-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-11-05 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-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors TIE1, TEK, MATK ALDH1A1 2121/4885NPSR1 4042/4885SMN1; SMN2 1616/4885

“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.