SCHEMBL5632263

SCHEMBL5632263

CC[C@@H]1CNCCN1c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.50
SLC6A4 P31645 14/20 0.50
SLC6A3 Q01959 14/20 0.50
CYP2D6 P10635 8/20 0.44
ADRB1 P08588 1/20 0.41
HTR2C P28335 4/20 0.40
HTR2B P41595 2/20 0.40
HTR6 P50406 1/20 0.39

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
SCHEMBL5631142 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL5631151 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
Trifluoroacetic Acid SCHEMBL5632440 0.88 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
Trifluoroacetic Acid SCHEMBL5632043 0.88 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL5632800 0.84 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL30309502 0.84 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL5631902 0.84 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL5631907 0.84 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1
SCHEMBL28168047 0.84 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL7149297 0.84 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6ADRB1

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
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
CN-1809545-A N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5HT2c ARENA PHARM INC (US) 2006-07-26 CN disclosed
EP-1644347-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT sb 2C /sb RECEPTOR ASSOCIATED DISEASES Arena Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005016902-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-02-24 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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases HTR2C, HTR2A, HTR5A SLC6A2 60/4885SLC6A4 56/4885SLC6A3 152/4885

“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.