SCHEMBL20169320

SCHEMBL20169320

Cc1cc(OCC2(C(=O)O)CC2)ncc1-c1ccc(-c2nc(C(F)(F)F)cn2COCCS(C)(C)C)c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.58

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
SCHEMBL20169381 0.97 DGAT1 (0.59) DGAT1
SCHEMBL17772417 0.91 DGAT1 (0.57) DGAT1
SCHEMBL9940390 0.91 DGAT1 (0.59) DGAT1
SCHEMBL17772395 0.90 DGAT1 (0.58) DGAT1
SCHEMBL20169379 0.90 DGAT1 (0.59) DGAT1
SCHEMBL15282836 0.88 DGAT1 (0.60) DGAT1
SCHEMBL15282653 0.84 DGAT1 (0.55) DGAT1
SCHEMBL15293914 0.82 DGAT1 (0.58) DGAT1
SCHEMBL15282812 0.81 DGAT1 (0.51) DGAT1
SCHEMBL9940402 0.80 DGAT1 (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9975871-B2 Continuous arycyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-05-22 US disclosed