SCHEMBL6183687

SCHEMBL6183687

NC(=O)c1ccc(F)cc1CCN1CCN(c2nsc3ccc(F)cc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.55
HTR7 P34969 5/20 0.55
DRD2 P14416 9/20 0.49
HTR2A P28223 9/20 0.49
HTR6 P50406 2/20 0.44
KCNH2 Q12809 2/20 0.43

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
SCHEMBL6107599 0.92 HTR1A (0.64) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6183693 0.84 HTR7 (0.60) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6171313 0.80 HTR1A (0.64) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6105385 0.79 HTR2A (0.58) HTR1AHTR7DRD2HTR2A
SCHEMBL6105285 0.78 HTR2A (0.57) HTR1AHTR7DRD2HTR2A
SCHEMBL6207057 0.77 HTR2A (0.58) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6106193 0.76 HTR1A (0.69) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6185255 0.75 HTR2A (0.59) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6189967 0.75 HTR2A (0.57) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL6106042 0.74 HTR1A (0.61) HTR1AHTR7DRD2HTR2AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546145-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2005-06-29 EP disclosed
WO-2004029048-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2004-04-08 WO disclosed
US-20040067960-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia DAVIS JAMIE MARIE (US) 2004-04-08 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-20040067960-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia HTR2C, CNR1, HTR2A HTR1A 7/4885HTR7 74/4885DRD2 4/4885

“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.