SCHEMBL23739002

SCHEMBL23739002

c1ccc2c(c1)Oc1c(ccc3c1c1c4ccccc4ccc1n3-c1cccc3ccccc13)C21c2ccccc2-c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL23184508 0.91 CNR1 (0.32) POLBKDM4EMEN1MAPTMAPK1
SCHEMBL23739014 0.90 TDP1 (0.32) POLBTDP1
SCHEMBL23184444 0.89 TDP1 (0.32) POLBTDP1
SCHEMBL23738998 0.88 KDM4E (0.31) KDM4E
SCHEMBL23738870 0.86 KDM4E (0.33) KDM4E
SCHEMBL23738873 0.85 ENPP3 (0.30)
SCHEMBL23739000 0.85
SCHEMBL23739087 0.85 POLB (0.32) POLBKDM4EMEN1MAPTMAPK1
SCHEMBL23738857 0.84 HKDC1 (0.30)
SCHEMBL23738730 0.84 POLB (0.31) POLBKDM4EMAPK1

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
EP-3388438-B1 SPIRO-STRUCTURED COMPOUND AND ORGANIC ELECTRONIC DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2021-08-11 EP disclosed