SCHEMBL29264884

SCHEMBL29264884

COC(=O)c1ccc(OC)cc1-c1cc(C)n(Cc2ccccc2)c(=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 2/20 0.50
▸ PLA2G2A P14555 7/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PLA2G1B P04054 1/20 0.46
▸ TSHR P16473 2/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ AR P10275 1/20 0.43
▸ P2RX7 Q99572 1/20 0.43
▸ MTNR1A P48039 1/20 0.43
▸ MTNR1B P49286 1/20 0.43
▸ NOTUM Q6P988 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ NTRK1 P04629 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 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
SCHEMBL29264850 0.92 KDM4E (0.52) MAPK8PLA2G2AKMT2AKDM4ESMN1; SMN2
SCHEMBL29264868 0.89 MAPK8 (0.50) MAPK8KMT2AKDM4ESMN1; SMN2TSHR
SCHEMBL29264863 0.88 SLC6A4 (0.45) MAPK8KMT2AKDM4EKLK1ALDH1A1
SCHEMBL29264847 0.88 KDM4E (0.50) MAPK8KMT2AKDM4ESMN1; SMN2TSHR
SCHEMBL29264864 0.87 NPSR1 (0.47) MAPK8PLA2G2AKMT2AKDM4ESMN1; SMN2
SCHEMBL29264853 0.86 KDM4E (0.47) MAPK8KMT2AKDM4ESMN1; SMN2TSHR
SCHEMBL29264882 0.83 KDM4E (0.47) MAPK8PLA2G2AKMT2AKDM4ESMN1; SMN2
SCHEMBL30612331 0.82 KLK1 (0.48) MAPK8PLA2G2AKMT2ASMN1; SMN2PLA2G1B
SCHEMBL29264871 0.81 NPSR1 (0.47) MAPK8PLA2G2AKMT2AKDM4ESMN1; SMN2
SCHEMBL29264856 0.78 KMT2A (0.47) MAPK8KMT2AKDM4ESMN1; SMN2TSHR

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-116854631-B 4-Aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2025-04-15 — — CN disclosed
CN-116854631-A 4-aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2023-10-10 — — CN disclosed
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