SCHEMBL3974789

SCHEMBL3974789

CN1CCN(CC(c2ccc(Cl)cc2)C2(O)CCC2)CC1

nearest known ligand 0.90

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.90
SLC6A3 Q01959 8/20 0.68
SLC6A4 P31645 6/20 0.68

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
Hydrochloric Acid SCHEMBL3978358 0.99 SLC6A2 (0.93) SLC6A2SLC6A3SLC6A4
SCHEMBL4627427 0.88 SLC6A2 (0.71) SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL3952528 0.87 SLC6A2 (0.73) SLC6A2SLC6A3SLC6A4
SCHEMBL3978146 0.86 SLC6A2 (0.90) SLC6A2SLC6A3SLC6A4
SCHEMBL3973718 0.86 SLC6A2 (0.69) SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL3979011 0.85 SLC6A2 (0.93) SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL3975365 0.85 SLC6A2 (0.71) SLC6A2SLC6A3SLC6A4
SCHEMBL4626016 0.85 SLC6A2 (0.67) SLC6A2SLC6A3SLC6A4
SCHEMBL4626050 0.85 SLC6A2 (0.72) SLC6A2SLC6A3SLC6A4
SCHEMBL3972448 0.85 SLC6A2 (0.93) SLC6A2SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1894227-A Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH CORP (US) 2007-01-10 CN claimed
EP-1673358-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE Wyeth (US) 2006-06-28 EP claimed
US-20050143394-A1 Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH (US) 2005-06-30 US claimed
WO-2005037808-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2005-04-28 WO claimed
US-7531543-B2 Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH (US) 2009-05-12 US disclosed
CN-1894227-A Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH CORP (US) 2007-01-10 CN disclosed
US-20050143394-A1 Phenylpiperazine cycloalkanol derivatives and methods of their use WYETH (US) 2005-06-30 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-20050143394-A1 Phenylpiperazine cycloalkanol derivatives and methods of their use HTR5A, PNMT, HTR3A SLC6A2 49/4885SLC6A3 100/4885SLC6A4 56/4885

“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.