SCHEMBL22294724

SCHEMBL22294724

C/C=C\c1c(C)n(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HDAC4 P56524 1/20 0.38
▸ RORC P51449 1/20 0.37
▸ AKR1C4 P17516 1/20 0.37
▸ AKR1C3 P42330 1/20 0.37
▸ AKR1C2 P52895 1/20 0.37
▸ AKR1C1 Q04828 1/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ PLA2G2A P14555 1/20 0.34
▸ AVPR1A P37288 1/20 0.33
▸ USP14 P54578 2/20 0.33
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ TNNI3 P19429 1/20 0.32
▸ TNNT2 P45379 1/20 0.32

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
SCHEMBL5021414 0.89 KDM4E (0.42) KDM4EATML3MBTL1RORCAKR1C4
SCHEMBL21913084 0.88 KDM4E (0.50) KDM4EATML3MBTL1RORCTSHR
SCHEMBL21416133 0.88 KDM4E (0.50) KDM4EATML3MBTL1RORCTSHR
SCHEMBL24900283 0.85 KDM4E (0.44) KDM4EATML3MBTL1RORCTSHR
SCHEMBL13672108 0.85 KDM4E (0.44) KDM4EATML3MBTL1HDAC4AKR1C4
SCHEMBL25833076 0.82 KDM4E (0.40) KDM4EATML3MBTL1HDAC4RORC
SCHEMBL21418276 0.82 KDM4E (0.41) KDM4EATML3MBTL1HDAC4AKR1C4
SCHEMBL24609412 0.82 KDM4E (0.41) KDM4EATML3MBTL1HDAC4AKR1C4
SCHEMBL24059858 0.81 KDM4E (0.35) KDM4EATML3MBTL1RORCTSHR
SCHEMBL24521419 0.81 KDM4E (0.40) KDM4EATML3MBTL1HDAC4RORC

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-3689882-A1 NEW MATERIALS WITH AZA-DIBENZOTHIOPHENE OR AZA-DIBENZOFURAN CORE FOR PHOLED Universal Display Corporation (US) 2020-08-05 — — EP disclosed
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