SCHEMBL3174760

SCHEMBL3174760

Clc1ccccc1OC1CCC[N]1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
SCD O00767 3/20 0.39
HTR2A P28223 5/20 0.36
HTR2C P28335 5/20 0.36
HTR2B P41595 5/20 0.36
TSHR P16473 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34

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
SCHEMBL3158944 0.79 SLC6A2 (0.43) SLC6A4SLC6A2SLC6A3TSHR
SCHEMBL2092663 0.75 SLC6A2 (0.39) SLC6A4SLC6A2SLC6A3
SCHEMBL1830085 0.74 HRH1 (0.41) SLC6A4SLC6A2SLC6A3TSHR
SCHEMBL2304242 0.73 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3SCD
SCHEMBL11539838 0.72 MEN1 (0.42) SLC6A4SLC6A2SLC6A3
SCHEMBL18573854 0.72 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3SCDHTR2A
SCHEMBL11959440 0.72 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3SCD
SCHEMBL2297386 0.71 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3SCDHTR2A
SCHEMBL9281104 0.71 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3SCDHTR2A
SCHEMBL3554168 0.71 SCD (0.41) SLC6A4SLC6A2SLC6A3SCDADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741934-B2 Inhibitors of ion channels PFIZER LIMITED (GB) 2014-06-03 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
EP-1995241-B1 Inhibitors of ion channels ICAGEN INC (US) 2010-03-17 EP disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
EP-1995241-A1 Inhibitors of ion channels ICAgen, Incorporated (US) 2008-11-26 EP disclosed
WO-2008118758-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (GB) 2008-10-02 WO 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 (2 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-20130072471-A1 Inhibitors of Ion Channels TRPV1, TRPV5, TRPA1 SLC6A4 207/4885SLC6A2 218/4885SLC6A3 248/4885
US-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 SLC6A4 207/4885SLC6A2 218/4885SLC6A3 248/4885

“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.