SCHEMBL10176798

SCHEMBL10176798

Cc1cc(-c2ccc(-c3nc(C(F)(F)F)c[nH]3)cn2)ccc1OCC(C)(C)C(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.60
AAK1 Q2M2I8 2/20 0.43

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
SCHEMBL9940532 0.87 DGAT1 (0.56) DGAT1
SCHEMBL9935278 0.80 DGAT1 (0.49) DGAT1AAK1
SCHEMBL9935277 0.78 DGAT1 (0.53) DGAT1AAK1
SCHEMBL15282778 0.77 DGAT1 (0.70) DGAT1
SCHEMBL9940381 0.77 DGAT1 (0.70) DGAT1
SCHEMBL15297160 0.77 DGAT1 (0.58) DGAT1
SCHEMBL15282817 0.77 DGAT1 (0.56) DGAT1AAK1
SCHEMBL20169332 0.77 DGAT1 (0.45) DGAT1AAK1
Potassium Ion SCHEMBL9940266 0.76 DGAT1 (0.59) DGAT1
SCHEMBL9940543 0.75 DGAT1 (1.00) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651915-B1 CONTINUOUS ARYCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-25 EP disclosed
WO-2012081736-A1 CONTINUOUS ARYCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-06-21 WO disclosed