SCHEMBL19229841

SCHEMBL19229841

c1ccc(-n2c3ccccc3c3cc4ccc5cccc6ccc(c4c56)c32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ CYP1A2 P05177 2/20 0.47
▸ ERBB2 P04626 1/20 0.47
▸ FYN P06241 1/20 0.47
▸ MAOA P21397 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ AHR P35869 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ TSHR P16473 3/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ POLB P06746 1/20 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
SCHEMBL16789905 0.94 L3MBTL1 (0.55) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16001353 0.89 L3MBTL1 (0.46) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16001355 0.89 L3MBTL1 (0.46) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL14460566 0.87 KDM4E (0.45) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL14460516 0.87 KDM4E (0.45) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16303057 0.87 MAPK1 (0.40) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16302977 0.86 ERBB2 (0.38) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL15834655 0.86 L3MBTL1 (0.50) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16786596 0.86 L3MBTL1 (0.50) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL16001354 0.86 KDM4E (0.41) L3MBTL1KDM4EATMCYP1A2ERBB2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9735368-B2 Organic electroluminescent devices UDC IRELAND LIMITED (IE) 2017-08-15 — — US disclosed
US-9735368-B2 Organic electroluminescent devices UDC IRELAND LIMITED (IE) 2017-08-15 — — US disclosed
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