Ethoxycarbonyl Group

Ethoxycarbonyl Group

SCHEMBL28044071

CCOC=O.Cn1cc(-c2c(OCC3CC3)ccc3[nH]ccc23)c2cc[nH]c(=O)c21

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.47

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
SCHEMBL28044070 0.79 BRD4 (0.44) BRD4
SCHEMBL16045116 0.79 BRD4 (0.46) BRD4
SCHEMBL16046578 0.79 BRD4 (0.57) BRD4
SCHEMBL16047916 0.78 BRD4 (0.47) BRD4
SCHEMBL16045727 0.78 BRD4 (0.75) BRD4
SCHEMBL16046716 0.76 BRD4 (0.45) BRD4
Ethoxycarbonyl Group SCHEMBL28044113 0.76 HTR1A (0.45) BRD4
SCHEMBL16045482 0.75 BRD4 (0.79) BRD4
SCHEMBL16045885 0.72 BRD4 (0.76) BRD4
SCHEMBL16046533 0.69 BRD4 (0.77) BRD4

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
CN-105164130-A Dihydro-pyrrolopyridone bromodomain inhibitors ABBVIE INC 2015-12-16 CN claimed
CN-105164130-A Dihydro-pyrrolopyridone bromodomain inhibitors ABBVIE INC 2015-12-16 CN disclosed