SCHEMBL14442452

SCHEMBL14442452

C[C@@H]1CNCCN1c1cccc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 13/20 0.46
HTR2B P41595 9/20 0.46
HTR2A P28223 5/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
LATS1 O95835 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
DPP4 P27487 1/20 0.39
HTR1A P08908 1/20 0.39
HTR6 P50406 1/20 0.38

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
SCHEMBL14442453 1.00 HTR2C (0.46) HTR2CHTR2BHTR2ASLC6A2SLC6A4
SCHEMBL5630306 0.88 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
SCHEMBL5630299 0.88 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
SCHEMBL5633015 0.88 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
SCHEMBL5305264 0.88 HTR2C (0.42) HTR2CHTR2BHTR2ALATS1CYP1A2
Hydrochloric Acid SCHEMBL5631402 0.86 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
Hydrochloric Acid SCHEMBL5633730 0.86 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
Hydrochloric Acid SCHEMBL5631397 0.86 HTR2C (0.44) HTR2CHTR2BHTR2ALATS1DPP4
SCHEMBL5631228 0.86 HTR2C (0.52) HTR2CHTR2BHTR2AHTR6
SCHEMBL5632309 0.86 HTR2C (0.52) HTR2CHTR2BHTR2AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases ARENA PHARMACEUTICALS, INC. 2007-08-02 US disclosed
US-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases ARENA PHARMACEUTICALS, INC. 2007-08-02 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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases HTR2C, HTR2A, HTR5A HTR2C 1/4885HTR2B 4/4885HTR2A 2/4885

“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.