SCHEMBL6217017

SCHEMBL6217017

NC1CCN(CC(F)Cc2coc3ccccc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 4/20 0.40
SLC6A4 P31645 1/20 0.40
PSMB8 P28062 9/20 0.37
PSMB5 P28074 8/20 0.37
DRD3 P35462 3/20 0.37
DRD4 P21917 2/20 0.37
GPR6 P46095 1/20 0.36
CA2 P00918 1/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL6213331 0.85 MEN1 (0.41) SIGMAR1HTR1ADRD2SLC6A4PSMB8
SCHEMBL6216523 0.81 MAOB (0.48) DRD2PSMB8PSMB5DRD3
SCHEMBL6215084 0.80 SIGMAR1 (0.55) SIGMAR1HTR1ADRD2SLC6A4DRD3
SCHEMBL5564087 0.78 DRD2 (0.50) SIGMAR1HTR1ADRD2SLC6A4DRD3
SCHEMBL6216772 0.78 PSMB8 (0.39) SIGMAR1HTR1ADRD2SLC6A4PSMB8
SCHEMBL6214069 0.76 DRD2 (0.42) SIGMAR1HTR1ADRD2SLC6A4DRD3
SCHEMBL5569217 0.76 SLC6A4 (0.48) SIGMAR1HTR1ADRD2SLC6A4DRD3
SCHEMBL7827907 0.76 KCNA3 (0.46) DRD2DRD3
SCHEMBL6212612 0.70 DRD2 (0.41) SIGMAR1HTR1ADRD2PSMB8PSMB5
SCHEMBL6214207 0.66 HTR1A (0.48) SIGMAR1HTR1ADRD2SLC6A4DRD3

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 SIGMAR1 80/4885HTR1A 94/4885DRD2 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.