SCHEMBL360460

SCHEMBL360460

Cn1cc(C(=O)Nc2cccc(S(N)(=O)=O)c2)cn1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHX9 Q08211 1/20 0.69
CA1 P00915 8/20 0.59
CA2 P00918 8/20 0.59
EGFR P00533 1/20 0.56
FGFR1 P11362 1/20 0.56
KDR P35968 1/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
CA9 Q16790 5/20 0.55
CA12 O43570 4/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
POLB P06746 1/20 0.52
CASP6 P55212 1/20 0.52
CTDSP1 Q9GZU7 1/20 0.52
SCN10A Q9Y5Y9 1/20 0.52

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
SCHEMBL359646 0.85 CA1 (0.61) DHX9CA1CA2EGFRFGFR1
SCHEMBL358411 0.84 CA12 (0.63) CA1CA2EGFRFGFR1KDR
SCHEMBL30926630 0.81 DHX9 (0.63) DHX9EGFRFGFR1KDRKMT2A
SCHEMBL27181602 0.81 DHX9 (0.63) DHX9EGFRFGFR1KDRKMT2A
SCHEMBL24934054 0.81 DHX9 (0.69) DHX9EGFRFGFR1KDRKMT2A
SCHEMBL14917101 0.81 DHX9 (0.69) DHX9EGFRFGFR1KDRKMT2A
SCHEMBL374330 0.79 DHX9 (0.65) DHX9EGFRFGFR1KDRALDH1A1
SCHEMBL13764406 0.77 MEN1 (0.76) CA1CA2KMT2AMEN1CA9
SCHEMBL14372369 0.77 CA1 (0.76) CA1CA2KMT2AMEN1CA9
SCHEMBL14372393 0.76 MEN1 (0.72) CA1CA2KMT2AMEN1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318750-B2 Organic compounds NOVARTIS AG (NL) 2012-11-27 US disclosed
US-8318750-B2 Organic compounds NOVARTIS AG (NL) 2012-11-27 US disclosed
US-8258141-B2 Organic compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
US-8258141-B2 Organic compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
EP-2013211-B1 PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2012-03-14 EP disclosed
US-20120004247-A1 ORGANIC COMPOUNDS NOVARTIS AG 2012-01-05 US disclosed
US-20120004247-A1 ORGANIC COMPOUNDS NOVARTIS AG 2012-01-05 US disclosed
US-20120004212-A1 ORGANIC COMPOUNDS NOVARTIS AG 2012-01-05 US disclosed
US-20120004212-A1 ORGANIC COMPOUNDS NOVARTIS AG 2012-01-05 US disclosed
EP-2322525-A1 Purine derivatives for use as adenosin A2A receptor agonists Novartis AG (CH) 2011-05-18 EP disclosed
US-20100286126-A1 Organic Compounds NOVARTIS AG (CH) 2010-11-11 US disclosed
US-20100286126-A1 Organic Compounds NOVARTIS AG (CH) 2010-11-11 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 (3 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-20100286126-A1 Organic Compounds CYP3A43, SLCO1B3, CYP2C19 DHX9 4016/4885CA1 3204/4885CA2 2138/4885
US-20120004212-A1 ORGANIC COMPOUNDS CYP3A43, SLCO1B3, CYP2C19 DHX9 4016/4885CA1 3204/4885CA2 2138/4885
US-20120004247-A1 ORGANIC COMPOUNDS CYP3A43, SLCO1B3, CYP2C19 DHX9 4016/4885CA1 3204/4885CA2 2138/4885

“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.