SCHEMBL9958502

SCHEMBL9958502

NC(=O)S(=O)(=O)OCCc1ccc(N)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
GFER P55789 1/20 0.43
CA1 P00915 8/20 0.43
CA2 P00918 8/20 0.43
CA9 Q16790 2/20 0.43
MET P08581 2/20 0.39
MAOB P27338 3/20 0.38
MAOA P21397 2/20 0.38
CYP19A1 P11511 1/20 0.38
CA12 O43570 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36

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
SCHEMBL9002486 0.80 RECQL (0.48) RECQLNPC1RAB9AGFERCA1
SCHEMBL27570548 0.77 RECQL (0.48) RECQLNPC1RAB9AGFERCA1
SCHEMBL6935649 0.76 RECQL (0.44) RECQLNPC1RAB9AGFERCA1
SCHEMBL3235233 0.74 NPC1 (0.57) RECQLNPC1RAB9AGFERCA1
SCHEMBL28833034 0.72 CA1 (0.33) CA1CA2CA9CA12CA6
Sulfuric Acid SCHEMBL8642565 0.71 GFER (0.70) RECQLGFERCA1CA2CA9
SCHEMBL30694096 0.69 NPC1 (0.56) NPC1RAB9AGFERCA1CA2
SCHEMBL2540602 0.69 NPC1 (0.56) NPC1RAB9AGFERCA1CA2
SCHEMBL21524969 0.69 CA1 (0.48) RECQLGFERCA1CA2CA9
SCHEMBL27735738 0.68 GFER (0.65) RECQLNPC1RAB9AGFERMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735589-B2 Process for the synthesis of naratriptan CIPLA LIMITED (IN) 2014-05-27 US disclosed
EP-2467373-B1 A PROCESS FOR THE SYNTHESIS OF NARATRIPTAN CIPLA LTD (IN) 2013-10-02 EP disclosed
US-20120220778-A1 Process for the synthesis of naratriptan CIPLA LIMITED (IN) 2012-08-30 US disclosed
EP-2467373-A2 A PROCESS FOR THE SYNTHESIS OF NARATRIPTAN Cipla Limited (IN) 2012-06-27 EP 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-20120220778-A1 Process for the synthesis of naratriptan ZFR, SPR, NPSR1 RECQL 4763/4885NPC1 396/4885RAB9A 1343/4885

“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.