Paroxetine

Paroxetine

SCHEMBL6100418

Cl.Fc1ccc([C@H]2CCNC[C@@H]2COc2ccc3c(c2)OCO3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A4

The experimentally established mechanism targets of Paroxetine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 3/20 0.98
CYP3A4 P08684 4/20 1.00
MEN1 O00255 3/20 1.00
KMT2A Q03164 3/20 1.00
USP2 O75604 1/20 1.00
GRK2 P25098 4/20 0.98
TP53 P04637 2/20 0.98
CYP1A2 P05177 2/20 0.98
CYP2D6 P10635 2/20 0.98
ABCB11 O95342 1/20 0.98
LMNA P02545 1/20 0.98
NFKB1 P19838 1/20 0.98
MAPK1 P28482 1/20 0.98
THPO P40225 1/20 0.98
PMP22 Q01453 1/20 0.98
SMN1; SMN2 Q16637 1/20 0.98
ALDH1A1 P00352 1/20 0.98
CYP2C9 P11712 1/20 0.98
HSD17B10 Q99714 1/20 0.98
NPC1 O15118 1/20 0.98

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
Paroxetine SCHEMBL9398356 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL9398351 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL2847926 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL29437926 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL5312626 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL33348 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL3854638 1.00 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL145268 0.99 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL8184989 0.99 CYP3A4 (0.98) CYP3A4MEN1KMT2AUSP2GRK2
Paroxetine SCHEMBL145267 0.99 CYP3A4 (1.00) CYP3A4MEN1KMT2AUSP2GRK2

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7138523-B2 Preparation of 4-(4-fluorophenyl)-N-alkylnipecotinate esters, 4-(4-fluorophenyl)-N-arylnipecotinate esters and 4-(4-fluorophenyl)-N-aralkylnipecotinate esters APOTEX PHARMACHEM INC. (CA) 2006-11-21 US claimed
US-20030220370-A1 Preparation of 4-(4-fluorophenyl)-N-alkylnipecotinate esters, 4-(4-fluorophenyl)-N-arylnipecotinate esters and 4-(4-fluorophenyl)-N-aralkylnipecotinate esters APOTEX PHARMACHEM INC (CA) 2003-11-27 US claimed
US-7138523-B2 Preparation of 4-(4-fluorophenyl)-N-alkylnipecotinate esters, 4-(4-fluorophenyl)-N-arylnipecotinate esters and 4-(4-fluorophenyl)-N-aralkylnipecotinate esters APOTEX PHARMACHEM INC. (CA) 2006-11-21 US disclosed
EP-1384720-A1 Process for drying paroxetine hydrochloride SUMIKA FINE CHEMICALS Co., Ltd. (JP) 2004-01-28 EP disclosed
US-20030220370-A1 Preparation of 4-(4-fluorophenyl)-N-alkylnipecotinate esters, 4-(4-fluorophenyl)-N-arylnipecotinate esters and 4-(4-fluorophenyl)-N-aralkylnipecotinate esters APOTEX PHARMACHEM INC (CA) 2003-11-27 US disclosed
WO-2003097599-A1 PREPARATION OF 4-(4-FLUOROPHENYL)-N-SUBSTITUTEDNIPECOTINATE ESTERS APOTEX PHARMACHEM INC. (CA) 2003-11-27 WO disclosed
US-5973155-A Process for preparing (-)-trans-N-p-fluorobenzoylmethyl-4-(p-fluorophenyl)-3-[[3,4-(methylened ioxy)phenoxy]methyl]-piperidine FERRER INTERNACIONAL, S.A. (ES) 1999-10-26 US disclosed
EP-0699198-B1 N-BENZOYLMETHYL SUBSTITUTED PAROXETINE DERIVATIVES FERRER INT (ES) 1999-06-30 EP disclosed
EP-0823907-B1 PROCESS FOR PREPARING (-)-TRANS-N-p-FLUOROBENZOYLMETHYL-4-(p-FLUOROPHENYL)-3-[[3,4-(METHYLENEDIOXY)PHENOXY]METHYL]-PIPERIDINE FERRER INT (ES) 1999-05-26 EP disclosed
EP-0339579-B1 Piperidine compositions and their preparation and use NOVO NORDISK AS (DK) 1998-07-15 EP disclosed
EP-0828735-A1 PROCESS FOR PREPARING 4-ARYL-PIPERIDINE DERIVATIVES NOVO NORDISK A/S (DK) 1998-03-18 EP disclosed
US-5227379-A 1-Heterocycyl-4-phenyl substituted, calcium-channel antagonists NOVO NORDISK A/S (DK) 1993-07-13 US disclosed
US-5208232-A Anoxia, migraine; antiepileptic and antiischemic agents NOVO NORDISK A/S (DK) 1993-05-04 US disclosed
US-5158961-A Treatment of anoxia, migraine, ischemica and epilepsy NOVO NORDISK A/S (DK) 1992-10-27 US disclosed
US-5019582-A Preventing Calcium Overload In Brain Cells NOVO NORDISK A/S (DK) 1991-05-28 US disclosed
US-5017585-A Piperidine compounds NOVO NORDISK A/S (DK) 1991-05-21 US disclosed
US-4985446-A CALCIUM OVERLOAD BLOCKERS IN BRAIN CELLS A/S FERROSAN (DK) 1991-01-15 US disclosed
US-4877799-A Method of treating calcium overload in brain cells of mammals A/S FERROSAN (DK) 1989-10-31 US disclosed
EP-0266574-A2 Piperidine compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-05-11 EP disclosed
EP-0223403-A2 Piperidine derivative, its preparation, and its use as medicament BEECHAM GROUP PLC (GB) 1987-05-27 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 (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-20030220370-A1 Preparation of 4-(4-fluorophenyl)-N-alkylnipecotinate esters, 4-(4-fluorophenyl)-N-arylnipecotinate esters and 4-(4-fluorophenyl)-N-aralkylnipecotinate esters PFAS, B3GNT2, APRT SLC6A4 594/4885CYP3A4 272/4885MEN1 3531/4885

“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.