SCHEMBL10614031

SCHEMBL10614031

COc1ccc(C(CN(C)C)C2(O)CCCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 1.00
SLC6A4 P31645 8/20 1.00
SLC6A3 Q01959 5/20 1.00
LMNA P02545 1/20 1.00
CNR1 P21554 1/20 1.00
HTR2A P28223 1/20 1.00
HRH1 P35367 1/20 1.00
HRH3 Q9Y5N1 1/20 1.00
OPRM1 P35372 1/20 0.72

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 SCHEMBL1560692 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL27838459 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL35154 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL60857 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
SCHEMBL10616028 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
(S)-Venlafaxine SCHEMBL3644633 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
(S)-Venlafaxine SCHEMBL4512264 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL3863025 0.99 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL6554144 0.99 SLC6A2 (0.97) SLC6A2SLC6A4SLC6A3LMNACNR1
Venlafaxine SCHEMBL6126163 0.99 SLC6A2 (0.97) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0112669-B1 PHENETHYLAMINE DERIVATIVES AND INTERMEDIATES THEREFOR AMERICAN HOME PRODUCTS CORPORATION (US) 1987-07-29 EP claimed
US-4535186-A CENTRAL NERVOUS SYSTEM ANTIDEPRESSANTS; VENLAFAXINE AMERICAN HOME PRODUCTS CORPORATION (US) 1985-08-13 US claimed
EP-0112669-A2 Phenethylamine derivatives and intermediates therefor AMERICAN HOME PRODUCTS CORPORATION (US) 1984-07-04 EP claimed
US-4761501-A INTERMEDIATES FOR ANTIDEPRESSANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1988-08-02 US disclosed
EP-0112669-B1 PHENETHYLAMINE DERIVATIVES AND INTERMEDIATES THEREFOR AMERICAN HOME PRODUCTS CORPORATION (US) 1987-07-29 EP disclosed
US-4611078-A ANTIDEPRESSANT INTERMEDIATES AMERICAN HOME PRODUCTS CORPORATION (US) 1986-09-09 US disclosed
US-4535186-A CENTRAL NERVOUS SYSTEM ANTIDEPRESSANTS; VENLAFAXINE AMERICAN HOME PRODUCTS CORPORATION (US) 1985-08-13 US disclosed
EP-0112669-A2 Phenethylamine derivatives and intermediates therefor AMERICAN HOME PRODUCTS CORPORATION (US) 1984-07-04 EP disclosed