Venlafaxine

Venlafaxine

SCHEMBL4180945

COc1ccc([C@H](CN(C)C)C2(O)CCCCC2)cc1.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A2SLC6A4

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 8/20 1.00
SLC6A4 known ✓ P31645 8/20 1.00
SLC6A3 Q01959 5/20 1.00
LMNA P02545 1/20 0.97
CNR1 P21554 1/20 0.97
HTR2A P28223 1/20 0.97
HRH1 P35367 1/20 0.97
HRH3 Q9Y5N1 1/20 0.97
OPRM1 P35372 1/20 0.70

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
Venlafaxine SCHEMBL3863025 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL41936 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
(S)-Venlafaxine SCHEMBL4512264 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL3423495 0.99 SLC6A2 (0.97) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL7140489 0.99 SLC6A2 (0.97) SLC6A2SLC6A4SLC6A3LMNACNR1
(S)-Venlafaxine SCHEMBL3644633 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL60857 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL10616028 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL1560692 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL10614031 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612210-B2 Process for selective synthesis of enantiomers of substituted 1-(2-amino-1-phenyl-ethyl)-cyclohexanols WYETH (US) 2009-11-03 US disclosed
US-20090111818-A1 Combinations of Eszopiclone and O-Desmethylvenlafaxine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders SEPRACOR INC. (US) 2009-04-30 US disclosed
EP-1680121-A4 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX INC (US) 2007-12-26 EP disclosed
US-20070135449-A1 Process for selective synthesis of enantiomers of substituted 1-(2-amino-1-phenyl-ethyl)-cyclohexanols WYETH (US) 2007-06-14 US disclosed
WO-2006136927-A1 EXTENDED RELEASE FORMULATIONS COMPRISING VENLAFAXINE GLENMARK PHARMACEUTICALS LIMITED (US) 2006-12-28 WO disclosed
EP-1680121-A2 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS CombinatoRx, Incorporated (US) 2006-07-19 EP disclosed
EP-1599212-A4 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX INC (US) 2006-02-08 EP disclosed
EP-1599212-A2 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS Combinatorx, Incorporated (US) 2005-11-30 EP disclosed
WO-2005037203-A2 METHODS AND REAGENTS FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX, INCORPORATED (US) 2005-04-28 WO disclosed
WO-2004073614-A2 COMBINATION THERAPY FOR THE TREATMENT OF IMMUNOINFLAMMATORY DISORDERS COMBINATORX, INCORPORATED (US) 2004-09-02 WO disclosed
US-20030190354-A1 Extended release composition comprising as active compound venlafaxine hydrochloride LYCORED LTD. (IL) 2003-10-09 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 (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-20090111818-A1 Combinations of Eszopiclone and O-Desmethylvenlafaxine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders HTR4, HTR5A, CHRNA5 SLC6A2 213/4885SLC6A4 55/4885SLC6A3 206/4885
US-20070135449-A1 Process for selective synthesis of enantiomers of substituted 1-(2-amino-1-phenyl-ethyl)-cyclohexanols MAP2K4, MAP2K1, MAP2K6 SLC6A2 3642/4885SLC6A4 3291/4885SLC6A3 2754/4885
US-20030190354-A1 Extended release composition comprising as active compound venlafaxine hydrochloride SLC6A2, HTR5A, SLC6A4 SLC6A2 1/4885SLC6A4 3/4885SLC6A3 6/4885

“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.