SCHEMBL5593754

SCHEMBL5593754

CN1CC[C@@H](c2ccc(F)cc2)[C@@H](CO)C1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.52

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
SCHEMBL5593759 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL3921318 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL1944024 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL7679057 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL13961124 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL12538468 1.00 SLC6A3 (0.52) SLC6A3
SCHEMBL1944023 1.00 SLC6A3 (0.52) SLC6A3
Hydrochloric Acid SCHEMBL10600725 0.98 SLC6A3 (0.51) SLC6A3
Hydrochloric Acid SCHEMBL10600718 0.98 SLC6A3 (0.51) SLC6A3
Hydrochloric Acid SCHEMBL10600732 0.98 SLC6A3 (0.51) SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264637-A1 PREPARATION OF PAROXETINE HYDROCHLORIDE HEMIHYDRATE DR. REDDY'S LABORATORIES LIMITED (IN) 2006-11-23 US claimed
WO-2007034270-A2 IMPROVED PROCESS FOR THE PREPARATION OF (-) TRANS-N-METHYL PAROXETINE ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2007-03-29 WO disclosed
US-20060264637-A1 PREPARATION OF PAROXETINE HYDROCHLORIDE HEMIHYDRATE DR. REDDY'S LABORATORIES LIMITED (IN) 2006-11-23 US disclosed
EP-1366041-A4 PREPARATION OF N-METHYLPAROXETINE AND RELATED INTERMEDIATE COMPOUNDS TEVA PHARMA (IL) 2004-12-22 EP disclosed
US-6777554-B2 REACTING SESAMOL-TETRABUTYLAMMONIUM SALT WITH 4-(4-FLUOROPHENYL)-3-CHLOROMETHYL-N-METHYL-PIPERIDINE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-08-17 US disclosed
EP-1366041-A1 PREPARATION OF N-METHYLPAROXETINE AND RELATED INTERMEDIATE COMPOUNDS TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2003-12-03 EP disclosed
US-20020151567-A1 Preparation of N-methylparoxetine and related intermediate compounds TEVA PHARMACEUTICAL INDUSTRIES LTD. (IR) 2002-10-17 US disclosed
WO-2002062790-A1 PREPARATION OF N-METHYLPAROXETINE AND RELATED INTERMEDIATE COMPOUNDS TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-08-15 WO disclosed
US-20020010155-A1 Novel process SMITHKLINE BEECHAM P.L.C. 2002-01-24 US disclosed
US-6066737-A Process for the preparation of optically enriched 4-aryl-3-hydromethyl substituted piperidines to be used as intermediates in the synthesis of paroxetine CHIROTECH TECHNOLOGY, LTD. (GB) 2000-05-23 US disclosed
EP-0300617-B1 Process for preparing aryl-piperidine carbinols BEECHAM GROUP PLC (GB) 1994-05-18 EP disclosed
US-5039803-A Reduction, quaternization; selective production of cis isomer; antidepressants BEECHAM PHARMACEUTICALS (GB) 1991-08-13 US disclosed
EP-0152273-B1 A PHENYLPIPERIDINE DERIVATIVE, AND ITS SALTS, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM, AND THEIR THERAPEUTIC USE A/S FERROSAN (DK) 1989-09-06 EP disclosed
EP-0300617-A1 Process for preparing aryl-piperidine carbinols BEECHAM GROUP PLC (GB) 1989-01-25 EP disclosed
US-4593036-A (-)-Trans-4-(4-fluorophenyl)-3-[(4-methoxyphenoxy)methyl]-1-methylpiperidine useful as 5-HT potentiator A/S FERROSAN (DK) 1986-06-03 US disclosed
US-4585777-A 5-HYDROXYTRYPTAMINE A/S FERROSAN (DK) 1986-04-29 US disclosed
EP-0152273-A2 A phenylpiperidine derivative, and its salts, their preparation, compositions containing them, and their therapeutic use A/S FERROSAN (DK) 1985-08-21 EP 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 (3 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-20020010155-A1 Novel process ADH1C, CBR1, ADH1A SLC6A3 4582/4885
US-20020151567-A1 Preparation of N-methylparoxetine and related intermediate compounds PNMT, INMT, SLC6A4 SLC6A3 175/4885
US-20060264637-A1 PREPARATION OF PAROXETINE HYDROCHLORIDE HEMIHYDRATE HTR5A, HTR6, HTR2B SLC6A3 49/4885

“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.