SCHEMBL30503534

SCHEMBL30503534

Cc1cc(Cl)nc2c1ccn2C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
LMNA P02545 3/20 0.39
HRH4 Q9H3N8 1/20 0.35
POLB P06746 1/20 0.33
KCNN3 Q9UGI6 2/20 0.33
HSD11B1 P28845 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE10A Q9Y233 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
TNKS O95271 1/20 0.30
PARP1 P09874 1/20 0.30
PARP15 Q460N3 1/20 0.30

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
SCHEMBL26631311 1.00 KDM4E (0.41) KDM4ECYP3A4CYP2C19HIF1ALMNA
SCHEMBL29697245 0.83 HRH4 (0.36) LMNAHRH4KCNN3HSD11B1
SCHEMBL22024527 0.83 HRH4 (0.36) LMNAHRH4KCNN3HSD11B1
SCHEMBL12754882 0.81 CYP1A2 (0.42) KDM4ELMNAHRH4POLBKCNN3
SCHEMBL30503520 0.80 HRH4 (0.34) HRH4
SCHEMBL26105826 0.80 HRH4 (0.34) HRH4
SCHEMBL30611847 0.80 CYP2A6 (0.36) KDM4ECYP3A4CYP2C19HIF1AHRH4
SCHEMBL26106551 0.80 CYP2A6 (0.36) KDM4ECYP3A4CYP2C19HIF1AHRH4
SCHEMBL31406243 0.78 KDM4E (0.40) KDM4ECYP3A4CYP2C19HIF1ALMNA
SCHEMBL30611921 0.76 HRH4 (0.32) HRH4

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
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed