SCHEMBL4167596

SCHEMBL4167596

O=C(c1csc(NS(=O)(=O)c2ccccc2)n1)N1CCC(COCC2CC2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 7/20 0.44
TRPC6 Q9Y210 7/20 0.44
ALDH1A1 P00352 4/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PHGDH O43175 1/20 0.39
PKM P14618 1/20 0.39
KDM5A P29375 1/20 0.38
KDM1A O60341 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
USP2 O75604 1/20 0.37
HTT P42858 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
SCHEMBL4176363 0.87 TACR3 (0.47) TRPC3TRPC6ALDH1A1CYP2C9CYP2C19
SCHEMBL4178123 0.85 SPR (0.45) TRPC3TRPC6ALDH1A1CYP2C9CYP2C19
SCHEMBL4176042 0.85 ALDH1A1 (0.47) TRPC3TRPC6ALDH1A1CYP2C9CYP2C19
SCHEMBL4178167 0.82 TRPC3 (0.54) TRPC3TRPC6ALDH1A1KDM5ASMN1; SMN2
SCHEMBL4173029 0.81 HCRTR1 (0.55) TRPC3TRPC6ALDH1A1MEN1KMT2A
SCHEMBL4173760 0.81 HCRTR1 (0.46) TRPC3TRPC6ALDH1A1CYP2C9CYP2C19
SCHEMBL4171049 0.80 ALDH1A1 (0.43) ALDH1A1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL4172986 0.80 ALDH1A1 (0.46) TRPC3TRPC6ALDH1A1CYP2C9CYP2C19
SCHEMBL4176879 0.80 ALDH1A1 (0.53) TRPC3TRPC6ALDH1A1MEN1KMT2A
SCHEMBL4172610 0.78 SCD5 (0.41) ALDH1A1CYP2C9CYP2C19MEN1KMT2A

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-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 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-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 TRPC3 57/4885TRPC6 84/4885ALDH1A1 3113/4885

“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.