SCHEMBL2561391

SCHEMBL2561391

Nc1ncc(-c2ccccc2C=O)cn1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 14/20 0.47
ALOX5AP P20292 10/20 0.47
XDH P47989 1/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
BLM P54132 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
IDO1 P14902 1/20 0.41
MAOB P27338 1/20 0.40
MAP4K4 O95819 1/20 0.39

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
SCHEMBL12523763 0.83 FEN1 (0.47) FEN1ALOX5APMAP4K4
SCHEMBL612568 0.77 ERN1 (0.47) XDHMEN1LMNATHRBBLM
SCHEMBL30497064 0.75 LMNA (0.60) XDHMEN1LMNATHRBBLM
SCHEMBL11768743 0.75 LMNA (0.60) XDHMEN1LMNATHRBBLM
SCHEMBL643994 0.75 XDH (0.51) XDHMEN1LMNATHRBBLM
SCHEMBL7999948 0.74 XDH (0.55) XDHMEN1LMNATHRBBLM
SCHEMBL2556068 0.74 MAP4K4 (0.44) MAP4K4
SCHEMBL14988401 0.74 XDH (0.44) FEN1ALOX5APXDHMEN1LMNA
SCHEMBL5711323 0.73 LMNA (0.57) XDHMEN1LMNATHRBBLM
SCHEMBL96494 0.73 LMNA (0.57) XDHMEN1LMNATHRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
CN-109956908-A A kind of transformation of sulphadiazine haptens and its application 贵州勤邦食品安全科学技术有限公司 2019-07-02 CN disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed