SCHEMBL30490656

SCHEMBL30490656

c1ccc2ncc(-c3nc4ccc5[nH]ncc5c4c4c3CCCC4)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 15/20 0.65
CDK2 P24941 14/20 0.65
CCNA1 P78396 14/20 0.65
STING1 Q86WV6 1/20 0.65
PBK Q96KB5 1/20 0.55
HASPIN Q8TF76 2/20 0.55
ROCK2 O75116 1/20 0.48
ROCK1 Q13464 1/20 0.48
CCNT1 O60563 1/20 0.45
CDK1 P06493 1/20 0.45
CCNB1 P14635 1/20 0.45
CCNA2 P20248 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK9 P50750 1/20 0.45
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
HSP90AA1 P07900 1/20 0.43

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
SCHEMBL22466838 1.00 FLT3 (0.65) FLT3CDK2CCNA1STING1PBK
SCHEMBL22466918 0.88 FLT3 (0.64) FLT3CDK2CCNA1STING1PBK
SCHEMBL30490720 0.88 FLT3 (0.64) FLT3CDK2CCNA1STING1PBK
SCHEMBL22477971 0.87 FLT3 (0.68) FLT3CDK2CCNA1STING1PBK
SCHEMBL22478402 0.87 FLT3 (0.68) FLT3CDK2CCNA1STING1PBK
SCHEMBL22477939 0.85 FLT3 (0.76) FLT3CDK2CCNA1STING1PBK
SCHEMBL30490704 0.83 FLT3 (0.63) FLT3CDK2CCNA1STING1PBK
SCHEMBL22467048 0.83 FLT3 (0.63) FLT3CDK2CCNA1STING1PBK
SCHEMBL22466882 0.83 FLT3 (0.72) FLT3CDK2CCNA1STING1PBK
SCHEMBL30490744 0.83 FLT3 (0.72) FLT3CDK2CCNA1STING1PBK

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-110662536-B Kinase network inhibitors and uses thereof 普渡研究基金会 2023-06-23 CN disclosed