SCHEMBL24103159

SCHEMBL24103159

CNc1cc2cccnc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.50
RIPK1 Q13546 14/20 0.47
CCNB2 O95067 1/20 0.47
CDK1 P06493 1/20 0.47
CCNB1 P14635 1/20 0.47
CCNB3 Q8WWL7 1/20 0.47
MAPT P10636 1/20 0.44
SNCA P37840 1/20 0.44
AXL P30530 1/20 0.42
NUDT1 P36639 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL745278 0.76 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL12333 0.76 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL14292147 0.74 CDC25B (0.57) DAORIPK1CDK1
SCHEMBL30678374 0.72 DAO (0.62) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL575029 0.72 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL1176828 0.72 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL2595303 0.72 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL27680363 0.72 DAO (0.62) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL27984199 0.72 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1
SCHEMBL20098707 0.72 DAO (0.53) DAORIPK1CCNB2CDK1CCNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
WO-2021250461-A1 SUBSTITUTED ISOQUINOLINYLMETHYL AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2021-12-16 WO disclosed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN disclosed
CN-102906092-A Certain triazolopyridine compounds and triazolopyrazine compounds, compositions thereof and methods of use thereof HUTCHISON MEDIPHARMA LTD 2013-01-30 CN disclosed