SCHEMBL992855

SCHEMBL992855

O=C(O)C1CCN1C1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
ACE P12821 4/20 0.34
BBOX1 O75936 1/20 0.34
ASPH Q12797 1/20 0.34
KDM8 Q8N371 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
HIF1AN Q9NWT6 1/20 0.34

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
SCHEMBL5080962 0.98 POLB (0.38) POLBGAAACEBBOX1ASPH
SCHEMBL15193691 0.98 POLB (0.34) POLBGAAACEBBOX1ASPH
SCHEMBL15194023 0.96 POLB (0.37) POLBGAAACEBBOX1ASPH
SCHEMBL29957169 0.91 ACE (0.32) ACE
SCHEMBL3718209 0.89 CNR2 (0.40) ACE
SCHEMBL3718206 0.89 CNR2 (0.40) ACE
SCHEMBL9527119 0.89 ACE (0.40) ACE
SCHEMBL9107688 0.89 ACE (0.41) ACE
SCHEMBL1952767 0.89 ACE (0.41) ACE
SCHEMBL11098876 0.87 CNR2 (0.40) POLBGAAACE

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454257-B1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBVIE INC (US) 2013-08-21 EP disclosed
EP-2454257-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES Abbott Laboratories (US) 2012-05-23 EP disclosed
CN-102471339-A Pyrrolopyridine inhibitors of kinases ABBOTT LAB 2012-05-23 CN disclosed
WO-2011008915-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 WO disclosed