SCHEMBL6216772

SCHEMBL6216772

NC1CCN(C(CF)Cc2coc3ccccc23)CC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 9/20 0.39
PSMB5 P28074 9/20 0.39
DRD2 P14416 4/20 0.36
DRD3 P35462 3/20 0.36
SIGMAR1 Q99720 2/20 0.36
HTR1A P08908 2/20 0.36
CA2 P00918 1/20 0.36
SLC6A4 P31645 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
DRD1 P21728 1/20 0.34
DRD4 P21917 1/20 0.34
HTR2A P28223 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
SCHEMBL6217017 0.78 SIGMAR1 (0.41) PSMB8PSMB5DRD2DRD3SIGMAR1
SCHEMBL6213331 0.76 MEN1 (0.41) PSMB8PSMB5DRD2DRD3SIGMAR1
SCHEMBL6215084 0.75 SIGMAR1 (0.55) DRD2DRD3SIGMAR1HTR1ASLC6A4
SCHEMBL5564087 0.73 DRD2 (0.50) DRD2DRD3SIGMAR1HTR1ACA2
SCHEMBL5569217 0.71 SLC6A4 (0.48) DRD2DRD3SIGMAR1HTR1ASLC6A4
SCHEMBL6214970 0.71 HTR7 (0.44) DRD2HTR1AHTR2A
SCHEMBL22875302 0.68 PSMB5 (0.41) PSMB8PSMB5DRD2SLC6A4CHRNB2
SCHEMBL1811006 0.68 GNAI3 (0.31)
SCHEMBL6214069 0.66 DRD2 (0.42) DRD2DRD3SIGMAR1HTR1ASLC6A4
SCHEMBL27992811 0.65 MAOB (0.53) PSMB8PSMB5DRD2DRD3SIGMAR1

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
EP-1122254-B1 4-Sulfonamide piperidine derivatives, method for their preparation and phamaceutical compositions containing them SERVIER LAB (FR) 2005-04-27 EP disclosed
US-6323217-B2 CARDIOVASCULAR DISORDERS ADIR ET COMPAGNIE (FR) 2001-11-27 US disclosed
US-20010034352-A1 Piperidine-4 sulphonamide compounds LES LABORATOIRES SERVIER (FR) 2001-10-25 US disclosed
EP-1122254-A2 4-Sulfonamide piperidine derivatives, method for their preparation and phamaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-08-08 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-20010034352-A1 Piperidine-4 sulphonamide compounds KDR, GLS, FLT1 PSMB8 3579/4885PSMB5 2233/4885DRD2 125/4885

“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.