SCHEMBL31015658

SCHEMBL31015658

COCCNCc1cc2c3c(ccc(F)c3c1)NC2=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.39
PDGFRB P09619 3/20 0.39
PRKCB P05771 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCH P24723 1/20 0.37
PRKCE Q02156 1/20 0.37
PRKCQ Q04759 1/20 0.37
PRKCD Q05655 1/20 0.37
CDK2 P24941 5/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HTT P42858 1/20 0.35
CASP3 P42574 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
P4HTM Q9NXG6 1/20 0.33
TGM2 P21980 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL31015615 0.86 CDK2 (0.34) KDRPDGFRBCDK2TGM2MAOB
SCHEMBL31015693 0.77 CDK2 (0.35) KDRCDK2KDM4EALDH1A1POLB
SCHEMBL31015583 0.75 DRD4 (0.41) CDK2POLBTGM2
SCHEMBL31015636 0.74 KDR (0.39) KDRPDGFRBCDK2HTTKDM4E
SCHEMBL31015666 0.74 CDK2 (0.40) KDRCDK2HTTKDM4EALDH1A1
SCHEMBL31015656 0.74 CDK2 (0.40) KDRCDK2POLBTGM2
SCHEMBL31015756 0.72 CDK2 (0.39) KDRCDK2KDM4EALDH1A1TGM2
SCHEMBL31015728 0.72 CDK2 (0.39) KDRCDK2POLBTGM2
SCHEMBL27310847 0.71 L3MBTL1 (0.36) KDRPDGFRBPRKCBPRKCAPRKCH
SCHEMBL31015641 0.67 CDK2 (0.40) KDRCDK2KDM4EALDH1A1TGM2

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-2024153246-A1 SUBSTITUTED TRICYCLIC COMPOUND AND USE THEREOF 海南先声再明医药股份有限公司 2024-07-25 WO disclosed