SCHEMBL7034737

SCHEMBL7034737

CN1CCN(c2cc(N)ccc2OCc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.54
HRH4 Q9H3N8 3/20 0.53
HTR1A P08908 1/20 0.49
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
SLC6A3 Q01959 1/20 0.49
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
RAD52 P43351 1/20 0.47
CHRNA7 P36544 2/20 0.46
HRH3 Q9Y5N1 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL17659126 0.85 HRH3 (0.59) HTR6HRH4HTR1ASLC6A2SLC6A4
SCHEMBL8900904 0.85 DRD2 (0.56) HTR6HRH4HTR1ASLC6A2SLC6A4
SCHEMBL14355885 0.83 HTR1A (0.68) HTR6HRH4HTR1ASLC6A2SLC6A4
SCHEMBL8912798 0.83 DRD2 (0.51) HTR6HRH4HTR1ASLC6A2SLC6A4
SCHEMBL6972479 0.82 MAPT (0.53) ALDH1A1GAAMAPK1KMT2AHSD17B10
SCHEMBL7034728 0.82 HSD17B10 (0.53) HTR6HRH4ALDH1A1GAATSHR
SCHEMBL31219636 0.80 HRH4 (0.54) HTR6HRH4ALDH1A1GAATSHR
SCHEMBL19381663 0.79 HTR6 (0.60) HTR6HRH4HTR1ASLC6A2SLC6A4
SCHEMBL3139131 0.79 HTR6 (0.67) HTR6HRH4HTR1ASLC6A4GAA
SCHEMBL9335253 0.78 MAPT (0.49) HTR6HTR1AALDH1A1GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 US claimed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 US claimed
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 US disclosed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 US disclosed
EP-0946539-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1999-10-06 EP disclosed
WO-1998027081-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1998-06-25 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 (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-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments TPMT, MPST, STS HTR6 1537/4885HRH4 1052/4885HTR1A 2960/4885

“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.