SCHEMBL8201495

SCHEMBL8201495

COC(=O)C(C)(C)CC(C)(C)CBr

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.35
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL116575 0.81
SCHEMBL17574065 0.81 DGAT1 (0.44) DGAT1ALDH1A1
SCHEMBL22105964 0.81 DGAT1 (0.39) DGAT1
SCHEMBL13228527 0.80 DGAT1 (0.37) DGAT1ALDH1A1
SCHEMBL8204239 0.79 CYP4F2 (0.46) ALDH1A1
SCHEMBL8153132 0.78 KDM4E (0.40) DGAT1ALDH1A1
SCHEMBL8144851 0.78 DGAT1 (0.35) DGAT1ALDH1A1
SCHEMBL8209508 0.77 DGAT1 (0.38) DGAT1
SCHEMBL17013836 0.77 TSHR (0.37) DGAT1ALDH1A1
SCHEMBL8209412 0.77 CYP4F2 (0.35) DGAT1ALDH1A1

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-2012131313-A1 ORGANOGOLD COMPLEXES AND METHODS FOR MAKING THE SAME THE UNIVERSITY OF SUSSEX (GB) 2012-10-04 WO disclosed
WO-2008033747-A9 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS INC (MA) 2008-07-24 WO disclosed
WO-2008033747-A2 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS, INC. (US) 2008-03-20 WO disclosed
WO-2008033744-A2 DNA METHYL TRANSFERASE INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 WO disclosed
WO-2008033745-A2 FUSED BICYCLIC PYRIMIDINES AS PTK INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 WO disclosed
WO-2008033743-A1 SUBSTITUTED 2-INDOLINONE AS PTK INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 WO disclosed
WO-2008033746-A2 TYROSINE KINASE INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2008-03-20 WO disclosed