Ethoxycarbonyl Group

Ethoxycarbonyl Group

SCHEMBL28795405

CCOC=O.COCOc1cncc(Br)c1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.38
CHRNA4 P43681 3/20 0.38
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL12179763 0.85 CHRNB2 (0.47) CHRNB2CHRNA4
Ethoxycarbonyl Group SCHEMBL27657859 0.76 RAB9A (0.41) KDM4E
SCHEMBL28934574 0.76 CHRNB2 (0.44) CHRNB2CHRNA4KDM4E
SCHEMBL30108653 0.76 CHRNB2 (0.44) CHRNB2CHRNA4KDM4E
SCHEMBL188568 0.75 CHRNB2 (0.49) CHRNB2CHRNA4CYP11B1CYP11B2
Ethoxycarbonyl Group SCHEMBL28203486 0.75 KDM4E (0.39) KDM4E
Benzoic Acid SCHEMBL23501628 0.73 ALOX15 (0.48)
SCHEMBL13779692 0.72 CHRNB2 (0.45) CHRNB2CHRNA4
SCHEMBL30174297 0.71 CHRNB2 (0.49) CHRNB2CHRNA4
SCHEMBL428322 0.71 CHRNB2 (0.49) CHRNB2CHRNA4

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
CN-102365281-A Indolizine derivative and medical application thereof KISSEI PHARMACEUTICAL 2012-02-29 CN disclosed