SCHEMBL23330871

SCHEMBL23330871

CONc1cnc(Cl)n2cnnc12

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 3/20 0.31
HRH4 Q9H3N8 3/20 0.30
HTR3A P46098 1/20 0.30

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
SCHEMBL23029863 0.82 TOP2A (0.36) MAPTHRH4HTR3A
SCHEMBL23331056 0.76 PIK3CA (0.38)
SCHEMBL23331262 0.76 TP53 (0.40) MAPTKDM4EKMT2A
SCHEMBL23330631 0.76 MAPT (0.37) MAPTKDM4EKMT2AHRH4
SCHEMBL23330678 0.76 TSHR (0.42) KDM4EKMT2A
SCHEMBL24857618 0.73 KDM4E (0.35) MAPTKDM4EKMT2AHRH4HTR3A
SCHEMBL24978035 0.73 LMNA (0.46) MAPTKDM4EKMT2A
SCHEMBL23331263 0.73 MAPT (0.36) MAPTKDM4EKMT2A
SCHEMBL23330539 0.69 HRH4 (0.33) HRH4HTR3A
SCHEMBL23330521 0.69 HTT (0.33) MAPTHRH4HTR3A

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-2021083380-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海科技大学 2021-05-06 WO disclosed