SCHEMBL29522705

SCHEMBL29522705

CCOC(=O)c1cc2cccc(OC)c2n2ccnc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 4/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
TBXAS1 P24557 1/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ELANE P08246 1/20 0.40

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
SCHEMBL22902414 1.00 MAPT (0.44) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL29274955 0.85 KDM4E (0.49) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL22902398 0.84 SYK (0.45) KDM4EALDH1A1HPGDKMT2AHSD17B10
SCHEMBL25365014 0.83 MET (0.44) LMNAKDM4EALDH1A1HPGDKMT2A
SCHEMBL29522713 0.83 MAPT (0.45) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL22902724 0.83 MAPT (0.45) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL22902779 0.82 MAPT (0.44) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL29522781 0.82 MAPT (0.44) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL27244340 0.80 KDM4E (0.50) MAPTPOLBLMNAKDM4EALDH1A1
SCHEMBL22902446 0.80 MAPT (0.44) MAPTPOLBLMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114423757-B Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2024-07-02 CN disclosed
CN-114423757-A Tricyclic heteroaryl compounds useful as IRAK4 inhibitors 百时美施贵宝公司 2022-04-29 CN disclosed