SCHEMBL4184017

SCHEMBL4184017

N#Cc1cccc(OC2CCCN(C(=O)c3csc(NS(=O)(=O)c4ccccc4)n3)C2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 1/20 0.42
KCNQ1 P51787 1/20 0.40
HRH1 P35367 1/20 0.39
CCR3 P51677 1/20 0.39
CCKBR P32239 1/20 0.39
AKR1C3 P42330 1/20 0.38
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
CPT1B Q92523 1/20 0.38
MGLL Q99685 3/20 0.37
PGR P06401 1/20 0.37
GAA P10253 2/20 0.37
FAAH O00519 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2B Q13224 1/20 0.37
EPHX2 P34913 1/20 0.37
CYP11B1 P15538 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
SCHEMBL4178536 0.90 TRPC3 (0.42) KAT6AGAAKDM4EMAPTATM
SCHEMBL4175075 0.88 GAA (0.43) KAT6AKCNQ1CCKBRCPT2CPT1A
SCHEMBL4181072 0.87 TRPV4 (0.40) KAT6ATRPC3TRPC6
SCHEMBL4306708 0.84 TRPC3 (0.44) TRPC3TRPC6
SCHEMBL4177020 0.84 TRPC3 (0.51) KCNQ1GAAMAPTTRPC3TRPC6
SCHEMBL3168748 0.81 SCN9A (0.46)
SCHEMBL4176042 0.81 ALDH1A1 (0.47) GAAKDM4EMAPTATMTRPC3
SCHEMBL4173605 0.79 NPC1 (0.41) GAAKDM4EMAPTATMGRIN1
SCHEMBL4178010 0.78 TRPC3 (0.51) GAATRPC3TRPC6
SCHEMBL4180139 0.77 ALDH1A1 (0.47) GAAKDM4EMAPTATMTRPC3

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 KAT6A 2080/4885KCNQ1 17/4885HRH1 947/4885

“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.