SCHEMBL21731373

SCHEMBL21731373

CCNc1cccc(Cc2ccc(Cl)nc2)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KCNH2 Q12809 1/20 0.38
CACNA1C Q13936 1/20 0.38
SCN5A Q14524 1/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EGFR P00533 1/20 0.37
APP P05067 3/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL21731428 0.87 KDM4E (0.43) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL21723209 0.83 KDM4E (0.39) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL21731372 0.83 GAA (0.40) GAAKDM4EMAPTL3MBTL1KCNH2
SCHEMBL21731414 0.80 KDM4E (0.41) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL21682616 0.80 MAPT (0.47) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL7971464 0.79 GAA (0.45) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL21731377 0.78 CYP11B1 (0.41) GAAKDM4EMAPTL3MBTL1
SCHEMBL21731369 0.78 KMT2A (0.43) GAAALDH1A1KMT2A
SCHEMBL21731410 0.75 GAA (0.41) GAAKDM4EMAPTL3MBTL1ALDH1A1
SCHEMBL21723173 0.75 GAA (0.41) GAAKDM4EMAPTL3MBTL1ALDH1A1

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
WO-2020035565-A1 PESTICIDALLY-ACTIVE MESOIONIC BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-02-20 WO disclosed