SCHEMBL21942546

SCHEMBL21942546

c1ccc(-n2c3ccccc3c3cc4c(cc32)[nH]c2cc3ccccc3cc24)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ SIGMAR1 Q99720 1/20 0.37
▸ AHR P35869 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ PDE7A Q13946 2/20 0.36
▸ PDE7B Q9NP56 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ IL1R1 P14778 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ MGAM O43451 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ SI P14410 2/20 0.34
▸ MGAM2 Q2M2H8 2/20 0.34

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
SCHEMBL21941570 0.94 L3MBTL1 (0.53) L3MBTL1KDM4EATMSIGMAR1AHR
SCHEMBL19832010 0.94 KDM4E (0.41) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL21375347 0.92 L3MBTL1 (0.62) L3MBTL1KDM4EATMSIGMAR1AHR
SCHEMBL15073864 0.88 KDM4E (0.53) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL15073860 0.88 KDM4E (0.53) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL29819577 0.88 KDM4E (0.56) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL29431053 0.88 KDM4E (0.56) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL13466760 0.88 KDM4E (0.56) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL21128604 0.88 KDM4E (0.41) L3MBTL1KDM4EATMAHRALDH1A1
SCHEMBL17989780 0.88 L3MBTL1 (0.64) L3MBTL1KDM4EATMSIGMAR1ALDH1A1

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-2020085793-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2020-04-30 — — WO disclosed
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