SCHEMBL7091052

SCHEMBL7091052

Clc1ccc(C2(CCCOC3CCOCC3)CCCNC2)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.57
SLC6A2 P23975 18/20 0.57
SLC6A3 Q01959 18/20 0.57
CYP2D6 P10635 1/20 0.54
CYP3A4 P08684 1/20 0.40

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
SCHEMBL8290900 0.84 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL7085751 0.82 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL7751548 0.81 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL3466139 0.79 SLC6A4 (0.72) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL3466142 0.79 SLC6A4 (0.72) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL7947168 0.79 SLC6A2 (0.48) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL7077339 0.78 SLC6A4 (0.57) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL6139409 0.77 SLC6A4 (0.85) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL3466791 0.77 SLC6A4 (0.85) SLC6A4SLC6A2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL6543325 0.76 SLC6A4 (0.83) SLC6A4SLC6A2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073838-A1 3-alkyl-3-phenyl-piperidines CHEN MICHAEL HUAI GU (US) 2003-04-17 US claimed
US-20010037023-A1 3-alkyl-3-phenyl-piperidines CHEN MICHAEL HUAI GU (US) 2001-11-01 US claimed
WO-1998011090-A2 3-ALKYL-3-PHENYL-PIPERIDINES WARNER-LAMBERT COMPANY (US) 1998-03-19 WO claimed
US-6602886-B2 3-alkyl-3-phenyl-piperidines WARNER-LAMBERT COMPANY 2003-08-05 US disclosed
US-20030073838-A1 3-alkyl-3-phenyl-piperidines CHEN MICHAEL HUAI GU (US) 2003-04-17 US disclosed
US-6433178-B2 ALKYL PYRIMIDINES SUBSTITUTED PIPERIDINE DERIVATIVES ARE USED AS TACHYKININ ANTAGONSIT, USEFUL IN THE TREATMENT OF PAIN, DEPRESSION, ANXIETY, PANIC, SCHIZOPHRENIA, NEURALGIA, ADDICTION DISORDER, INFLAMMATION, AND NEUROLOGICAL DISORDERS WARNER-LAMBERT COMPANY 2002-08-13 US disclosed
US-20010037023-A1 3-alkyl-3-phenyl-piperidines CHEN MICHAEL HUAI GU (US) 2001-11-01 US disclosed
US-6040316-A TACHYKININ ANTAGONISTS TREATING PAIN, DEPRESSION, ANXIETY, PANIC, SCHIZOPHRENIA, NEURALGIA, ADDICTION DISORDERS, INFLAMMATORY DISEASES, GASTROINTESTINAL DISORDERS, VASCULAR DISORDERS, AND NEUROPATHOLOGICAL DISORDERS WARNER-LAMBERT COMPANY (US) 2000-03-21 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 (2 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-20010037023-A1 3-alkyl-3-phenyl-piperidines TAC3, KCNK3, ACKR3 SLC6A4 89/4885SLC6A2 269/4885SLC6A3 16/4885
US-20030073838-A1 3-alkyl-3-phenyl-piperidines TAC3, KCNK3, ACKR3 SLC6A4 89/4885SLC6A2 269/4885SLC6A3 16/4885

“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.