SCHEMBL9468465

SCHEMBL9468465

O=C1CC(OC(=O)CBr)C(=O)N1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.35
CYP19A1 P11511 3/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
APEX1 P27695 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 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
SCHEMBL977159 0.85 MAP3K14 (0.38) MAP3K14CYP19A1LMNAMAPTPKM
SCHEMBL3805680 0.84 MAP3K14 (0.36) MAP3K14LMNAMAPTPKMMEN1
SCHEMBL10488014 0.82 MAP3K14 (0.35) MAP3K14LMNAMAPTPKMMEN1
SCHEMBL1332286 0.82 NPC1 (0.36) MAP3K14CYP19A1LMNAMAPTPKM
SCHEMBL11095324 0.82 NPC1 (0.36) MAP3K14CYP19A1LMNAMAPTPKM
SCHEMBL1273192 0.82 MAP3K14 (0.35) MAP3K14LMNAMAPTPKMMEN1
SCHEMBL13386960 0.81 MAP3K14 (0.32) MAP3K14
SCHEMBL20589363 0.81 PRKCA (0.38) MAP3K14CYP19A1LMNAMAPTPKM
SCHEMBL6551912 0.79 HSD17B10 (0.39) CYP19A1
SCHEMBL7264550 0.77 MAP3K14 (0.40) MAP3K14CYP19A1LMNAMAPTPKM

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
US-5262035-A Polymer and enzyme E. HELLER AND COMPANY (US) 1993-11-16 US disclosed
WO-1992012254-A1 ENZYME ELECTRODES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1992-07-23 WO disclosed