Sibutramine

Sibutramine

SCHEMBL3707643

CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1.CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A2SLC6A3SLC6A4

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

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A3 known ✓ Q01959 16/20 1.00
SLC6A4 known ✓ P31645 16/20 1.00
SLC6A2 known ✓ P23975 9/20 1.00
KCNH2 Q12809 3/20 1.00
CHRM2 P08172 1/20 1.00
ADRA2A P08913 1/20 1.00
ADRA2B P18089 1/20 1.00
ADRA2C P18825 1/20 1.00
HTR2A P28223 1/20 1.00
OPRK1 P41145 1/20 1.00
HTR2B P41595 1/20 1.00
CYP3A4 P08684 2/20 0.97
ALOX15 P16050 2/20 0.97
TSHR P16473 2/20 0.97
ALDH1A1 P00352 1/20 0.97
LMNA P02545 1/20 0.97
MAPT P10636 1/20 0.97
MAPK1 P28482 1/20 0.97
TP53 P04637 1/20 0.62

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
Sibutramine SCHEMBL2955 1.00 SLC6A3 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL16312 1.00 SLC6A3 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL2672138 1.00 SLC6A3 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL1598 0.98 CYP3A4 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL6431587 0.98 SLC6A3 (0.97) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL7191483 0.98 CYP3A4 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL7626175 0.98 CYP3A4 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL7189499 0.98 CYP3A4 (1.00) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL2916993 0.98 SLC6A3 (0.97) SLC6A3SLC6A4SLC6A2KCNH2CHRM2
Sibutramine SCHEMBL4594859 0.97 CYP3A4 (0.97) SLC6A3SLC6A4SLC6A2KCNH2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010082216-A2 NOVEL SALTS OF SIBUTRAMINE AND THEIR CRYSTAL FORMS MATRIX LABORATORIES LTD (IN) 2010-07-22 WO disclosed
WO-2005079284-A2 METHODS AND REAGENTS FOR THE TREATMENT OF DISEASES AND DISORDERS ASSOCIATED WITH INCREASED LEVELS OF PROINFLAMMATORY CYTOKINES COMBINATORX, INCORPORATED (US) 2005-09-01 WO disclosed
CN-1190549-C Weight-lossing fabric and its preparing process ZHONGMAI SCIENCE & TECHNOLOGY (CN) 2005-02-23 CN disclosed
CN-1379149-A Weight-lossing fabric and its preparing process ZHONGMAI SCIENCE AND TECHNOLOG (CN) 2002-11-13 CN disclosed
WO-2002060427-A2 METHODS OF USING AND COMPOSITIONS COMPRISING (+) SIBUTRAMINE OPTIONALLY IN COMBINATION WITH OTHER PHARMACOLOGICALLY ACTIVE COMPOUNDS SEPRACOR INC. (US) 2002-08-08 WO disclosed
EP-1007023-A1 MEDICAL TREATMENT KNOLL AKTIENGESELLSCHAFT (DE) 2000-06-14 EP disclosed
WO-1998013033-A1 MEDICAL TREATMENT KNOLL AKTIENGESELLSCHAFT (DE) 1998-04-02 WO disclosed