SCHEMBL23052343

SCHEMBL23052343

COc1cc2cc(C3CC(c4ccco4)=NN3C(C)=O)c(Cl)nc2cc1OC

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.74
▸ PKM P14618 2/20 0.62
▸ POLB P06746 2/20 0.61
▸ RXFP1 Q9HBX9 1/20 0.61
▸ P2RY6 Q15077 1/20 0.58
▸ MAPT P10636 1/20 0.56
▸ XDH P47989 1/20 0.55

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
SCHEMBL3314961 0.76 XBP1 (0.60) KDM4EPKMPOLB
SCHEMBL3314444 0.74 PKM (0.55) KDM4EPKMPOLBMAPT
SCHEMBL3311133 0.74 MAOB (0.58) KDM4EPKMMAPT
SCHEMBL3312487 0.74 KDM4E (0.64) KDM4EPKMP2RY6MAPT
SCHEMBL24767745 0.74 P2RY6 (1.00) KDM4EPKMPOLBRXFP1P2RY6
SCHEMBL24768795 0.72 P2RY6 (0.85) KDM4EPKMPOLBRXFP1P2RY6
SCHEMBL3316509 0.72 XBP1 (0.76) KDM4EPKMPOLBRXFP1P2RY6
SCHEMBL3312926 0.72 XBP1 (0.76) KDM4EPKMPOLBRXFP1MAPT
SCHEMBL3310763 0.70 PKM (0.57) KDM4EPKMP2RY6
SCHEMBL23052416 0.69 LMNA (0.58) KDM4EMAPT

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-2021039824-A1 RNA METHYLTRANSFERASE INHIBITOR, SCREENING METHOD THEREFOR, ANTI-CANCER AGENT EFFICACY ASSESSMENT MARKER, AND KIT FOR EFFECTIVELY PREDICTING FTSJ1 INHIBITOR 国立大学法人 岡山大学 2021-03-04 — — WO disclosed
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