SCHEMBL3710125

SCHEMBL3710125

COC(=O)C[C@H]1CC[C@H](c2ccc(N3CCc4nc(OC)nc(N)c4C3=O)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.60

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
SCHEMBL3710128 1.00 DGAT1 (0.60) DGAT1
SCHEMBL3053878 0.92 DGAT1 (0.59) DGAT1
SCHEMBL2770581 0.92 DGAT1 (0.69) DGAT1
SCHEMBL3053882 0.92 DGAT1 (0.59) DGAT1
SCHEMBL13196374 0.92 DGAT1 (0.69) DGAT1
SCHEMBL2770585 0.92 DGAT1 (0.69) DGAT1
Hydrochloric Acid SCHEMBL2771345 0.91 DGAT1 (0.68) DGAT1
Hydrochloric Acid SCHEMBL2771347 0.91 DGAT1 (0.68) DGAT1
SCHEMBL2769794 0.91 DGAT1 (0.62) DGAT1
SCHEMBL3050155 0.90 DGAT1 (0.49) 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-2393811-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-5(6H)-ONE DERIVATIVES Pfizer Inc. (US) 2011-12-14 EP disclosed
WO-2010089686-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-5(6H)-ONE DERIVATIVES PFIZER INC. (US) 2010-08-12 WO disclosed