SCHEMBL22172017

SCHEMBL22172017

O=c1c2ccccc2n(-c2ccccc2)c2cnccc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KDM4C Q9H3R0 1/20 0.43
DYRK1A Q13627 1/20 0.43
P2RX4 Q99571 2/20 0.42
HKDC1 Q2TB90 1/20 0.42
MAPK1 P28482 1/20 0.42
MAPK8 P45983 2/20 0.41
KMT2A Q03164 1/20 0.41
PGR P06401 1/20 0.41
ALOX12 P18054 1/20 0.40
REN P00797 1/20 0.40
MAPK9 P45984 1/20 0.40
HTT P42858 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
SCHEMBL22172011 0.95 KDM4C (0.47) KDM4EATML3MBTL1KDM4CDYRK1A
SCHEMBL15428469 0.90 KDM4E (0.67) KDM4EATML3MBTL1DYRK1AREN
SCHEMBL30927975 0.84 KDM4E (0.74) KDM4EATML3MBTL1P2RX4HKDC1
SCHEMBL4304114 0.84 KDM4E (0.74) KDM4EATML3MBTL1P2RX4HKDC1
SCHEMBL26329792 0.81 KDM4E (0.55) KDM4EATML3MBTL1DYRK1AREN
SCHEMBL17349045 0.80 KDM4E (0.49) KDM4EATML3MBTL1DYRK1AREN
SCHEMBL18381787 0.80 KDM4E (0.53) KDM4EATML3MBTL1DYRK1AMAPK1
SCHEMBL15945585 0.80 KDM4E (0.53) KDM4EATML3MBTL1DYRK1AKMT2A
SCHEMBL18958369 0.80 KDM4E (0.53) KDM4EATML3MBTL1DYRK1AKMT2A
SCHEMBL23438634 0.80 KDM4E (0.52) KDM4EATML3MBTL1DYRK1AALOX12

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-2020135686-A1 ORGANIC COMPOUND WITH CARBAZOLE DERIVATIVE AS CORE AND APPLICATION THEREOF TO ORGANIC ELECTROLUMINESCENT DEVICE 江苏三月光电科技有限公司 2020-07-02 WO disclosed