SCHEMBL3671547

SCHEMBL3671547

CC1=CC(C)C(C)=C1c1ccccc1CC(C)(C)N

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HTR2A P28223 1/20 0.31
SLC6A4 P31645 1/20 0.31
HRH1 P35367 1/20 0.31
HTR2B P41595 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL79791 0.73 ALDH1A1 (0.43)
SCHEMBL3671544 0.70 IDO1 (0.33)
SCHEMBL11060021 0.69 DPP4 (0.55) SLC6A2TAAR1
SCHEMBL3638610 0.66 TAAR1 (0.52) SLC6A2TAAR1HTR2ASLC6A4HRH1
SCHEMBL29987056 0.66 TAAR1 (0.52) SLC6A2TAAR1HTR2ASLC6A4HRH1
Hydrochloric Acid SCHEMBL12802356 0.64 TAAR1 (0.50) SLC6A2TAAR1HTR2ASLC6A4HRH1
SCHEMBL7608261 0.64 SLC6A2 (0.41) SLC6A2TAAR1HTR2ASLC6A4
SCHEMBL28293880 0.62 TAAR1 (0.52) SLC6A2TAAR1HTR2ASLC6A4HRH1
SCHEMBL23458536 0.61 TAAR1 (0.50) SLC6A2TAAR1HTR2ASLC6A4HRH1
SCHEMBL7172698 0.61 IDO1 (0.52) SLC6A2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966223-B1 CATALYST COMPOSITION COMPRISING GROUP 4 TRANSITION METAL COMPLEXES AND METHOD FOR PREPARING POLYOLEFINS USING THE SAME LG CHEMICAL LTD (KR) 2013-08-14 EP disclosed
US-7807762-B2 Catalyst composition comprising Group 4 transition metal complexes and method for preparing polyolefins using the same LG CHEM, LTD. (KR) 2010-10-05 US disclosed
US-20090005525-A1 Catalyst Composition Comprising Group 4 Transition Metal Complexes and Method for Preparing Polyolefins Using the Same LG CHEM , LTD. (KR) 2009-01-01 US disclosed
EP-1966223-A1 CATALYST COMPOSITION COMPRISING GROUP 4 TRANSITION METAL COMPLEXES AND METHOD FOR PREPARING POLYOLEFINS USING THE SAME LG Chem. Ltd. (KR) 2008-09-10 EP disclosed
WO-2007078133-A1 CATALYST COMPOSITION COMPRISING GROUP 4 TRANSITION METAL COMPLEXES AND METHOD FOR PREPARING POLYOLEFINS USING THE SAME LG CHEM. LTD. (KR) 2007-07-12 WO disclosed