Ethoxycarbonyl Group

Ethoxycarbonyl Group

SCHEMBL27778366

CCOC=O.Fc1cc(Br)c2cc[nH]c2c1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.40
AHR P35869 3/20 0.35
TRPA1 O75762 2/20 0.30
P2RX7 Q99572 1/20 0.30

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
SCHEMBL30597608 0.81 AHR (0.50) RHEBAHRTRPA1
SCHEMBL996179 0.81 AHR (0.50) RHEBAHRTRPA1
Ethoxycarbonyl Group SCHEMBL27447133 0.76 AHR (0.62) AHR
Ethoxycarbonyl Group SCHEMBL28658781 0.76 AHR (0.62) AHR
SCHEMBL28486022 0.74 GPR84 (0.38) AHRTRPA1P2RX7
Ethoxycarbonyl Group SCHEMBL27551543 0.73 NR3C1 (0.35) P2RX7
Ethoxycarbonyl Group SCHEMBL27906753 0.73 TRPA1 (0.40) RHEBAHRTRPA1
Ethoxycarbonyl Group SCHEMBL27473000 0.72 P2RX7 (0.34) TRPA1P2RX7
Ethoxycarbonyl Group SCHEMBL27309525 0.72 RHEB (0.43) RHEBAHRP2RX7
Ethoxycarbonyl Group SCHEMBL27694364 0.71 DAO (0.35) RHEBP2RX7

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-101535253-A Indole and benzofuran 2-carboxamide derivatives INDOLE AND BENZOFURAN 2 CARBOX (CH) 2009-09-16 CN disclosed