SCHEMBL2324022

SCHEMBL2324022

Cc1cc(C(N)=NO)ccc1C1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
KMT2A Q03164 3/20 0.38
GFER P55789 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
OPRL1 P41146 4/20 0.38
RECQL P46063 1/20 0.37
HTR7 P34969 1/20 0.36
MAPT P10636 2/20 0.34
HTT P42858 2/20 0.34
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOA P21397 1/20 0.34
F2 P00734 1/20 0.33
PLG P00747 1/20 0.33
PLAU P00749 1/20 0.33
PLAT P00750 1/20 0.33
KLK1 P06870 1/20 0.33
PRSS1 P07477 1/20 0.33

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
SCHEMBL2324019 1.00 LMNA (0.38) LMNAKMT2AGFERL3MBTL1MEN1
SCHEMBL2327626 0.83 MAOA (0.46) KMT2AMEN1MAPK1OPRL1RECQL
SCHEMBL2327622 0.83 MAOA (0.46) KMT2AMEN1MAPK1OPRL1RECQL
SCHEMBL13364080 0.82 OPRL1 (0.39) MAPK1OPRL1MAOAF2PLG
SCHEMBL2328170 0.75 KMT2A (0.57) LMNAKMT2AGFERL3MBTL1MEN1
SCHEMBL2328166 0.75 KMT2A (0.57) LMNAKMT2AGFERL3MBTL1MEN1
SCHEMBL2324026 0.74 OPRL1 (0.40) OPRL1F2PLGPLAUPLAT
SCHEMBL14320620 0.73 OPRL1 (0.43) LMNAKMT2AL3MBTL1MEN1OPRL1
SCHEMBL12391608 0.72 PDE4D (0.48) RECQL
SCHEMBL12391605 0.72 PDE4D (0.48) RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356113-B1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS BAYER IP GMBH (DE) 2015-01-07 EP disclosed
EP-2356113-A1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS Bayer Schering Pharma Aktiengesellschaft (DE) 2011-08-17 EP disclosed
EP-2356112-A1 HETEROAROMATIC COMPOUNDS FOR USE AS HIF INHIBITORS Bayer Schering Pharma Aktiengesellschaft (DE) 2011-08-17 EP disclosed
WO-2010054764-A1 HETEROAROMATIC COMPOUNDS FOR USE AS HIF INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-20 WO disclosed
WO-2010054763-A1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-20 WO disclosed