SCHEMBL25118656

SCHEMBL25118656

c1ccc(-c2ccccc2-c2cc(C3CCC3)nc(-c3cccc4ccccc34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ HPGD P15428 3/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ADORA3 P0DMS8 2/20 0.37
▸ ADORA2B P29275 2/20 0.37

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
SCHEMBL5775973 0.77 CDK1 (0.44) MAPTTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL17969961 0.77 MEN1 (0.50) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL17969965 0.77 MEN1 (0.50) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL18732401 0.76 MAPT (0.53) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL17412397 0.76 KDM4E (0.44) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL17969975 0.75 ENPP3 (0.53) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL25682940 0.75 MEN1 (0.46) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL17970015 0.74 MEN1 (0.53) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL17969988 0.74 MEN1 (0.53) KDM4EALDH1A1MAPTHPGDTDP1
SCHEMBL19397409 0.74 ENPP3 (0.51) KDM4EALDH1A1MAPTHPGDTDP1

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-4159724-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2023-04-05 — — EP disclosed
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