SCHEMBL17907368

SCHEMBL17907368

Nc1ncnc2c1C(=O)N(c1ccc(-c3cnn(C4=NC=C4)c3)cc1)CCO2

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.65

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
SCHEMBL17907325 0.81 DGAT1 (0.67) DGAT1
SCHEMBL22894484 0.80 DGAT1 (0.63) DGAT1
SCHEMBL12208228 0.79 DGAT1 (1.00) DGAT1
SCHEMBL17907289 0.79 DGAT1 (0.67) DGAT1
SCHEMBL19557950 0.79 DGAT1 (0.64) DGAT1
SCHEMBL17907351 0.78 DGAT1 (0.66) DGAT1
SCHEMBL16532122 0.77 DGAT1 (0.64) DGAT1
SCHEMBL16532125 0.77 DGAT1 (0.64) DGAT1
SCHEMBL17918487 0.77 DGAT1 (0.64) DGAT1
SCHEMBL22894663 0.76 DGAT1 (0.61) 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-3042907-A1 DGAT1 INHIBITOR AND PREPARATION METHOD AND USE THEREOF Medshine Discovery Inc. (CN) 2016-07-13 EP claimed
EP-3042907-A1 DGAT1 INHIBITOR AND PREPARATION METHOD AND USE THEREOF Medshine Discovery Inc. (CN) 2016-07-13 EP disclosed