SCHEMBL27447170

SCHEMBL27447170

CC1(C)C=CC=C(c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)C=C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.39
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
MAPT P10636 4/20 0.34
HPGD P15428 4/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 3/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
MAPK1 P28482 2/20 0.33
CYP2C19 P33261 2/20 0.33
GLA P06280 1/20 0.33
ATM Q13315 1/20 0.33
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
POLB P06746 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2B P29275 1/20 0.32
WHR1 P49842 1/20 0.31

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
SCHEMBL25923595 0.88 L3MBTL1 (0.43) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL22072005 0.86
SCHEMBL22296632 0.83 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL21972972 0.79 MEN1 (0.40) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL26730292 0.75 L3MBTL1 (0.42) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL20829148 0.74 CYP19A1 (0.40) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL21972969 0.74 L3MBTL1 (0.41) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL22212825 0.73 KMT2A (0.40) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL26730296 0.72 L3MBTL1 (0.34) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL24372678 0.72 L3MBTL1 (0.61) L3MBTL1MEN1KMT2AMAPTHPGD

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
EP-3790875-B1 N-HETEROARYLENE COMPOUNDS WITH LOW LUMO ENERGIES NOVALED GMBH (DE) 2024-07-03 EP disclosed