SCHEMBL17907388

SCHEMBL17907388

CCC1=CN=C1N1CCN(c2c(C)cc(N(CCO)C(=O)c3c(Cl)ncnc3Cl)cc2CC)C1=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 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
SCHEMBL17907316 0.81 ENPP2 (0.35) DGAT1
SCHEMBL17907286 0.69 ENPP2 (0.36) DGAT1
SCHEMBL12208091 0.69 DGAT1 (0.37) DGAT1
SCHEMBL16532114 0.68 DGAT1 (0.36) DGAT1
SCHEMBL16532005 0.65 TP53 (0.37) DGAT1
SCHEMBL17907389 0.65 TP53 (0.37) DGAT1
SCHEMBL18086606 0.64 TP53 (0.39) DGAT1
SCHEMBL12208122 0.64 MRGPRX4 (0.39) DGAT1
SCHEMBL16531968 0.64 TP53 (0.36) DGAT1
SCHEMBL16532016 0.64 DGAT1 (0.35) 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
EP-3042907-A1 DGAT1 INHIBITOR AND PREPARATION METHOD AND USE THEREOF Medshine Discovery Inc. (CN) 2016-07-13 EP disclosed