SCHEMBL18960915

SCHEMBL18960915

c1ccc(-c2nc(-c3ccc4c(c3)Sc3ccccc3S4)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NTSR1 P30989 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ ADORA2A P29274 4/20 0.34
▸ ADORA1 P30542 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ ABCG2 Q9UNQ0 3/20 0.33
▸ WHR1 P49842 1/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ USP2 O75604 1/20 0.33

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
SCHEMBL18960914 0.98 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18960925 0.90 MEN1 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL18960918 0.88 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12487208 0.87 MAP4K4 (0.38) MAPTLMNA
SCHEMBL18960912 0.86 LMNA (0.32) MAPTLMNAMAPK1CYP3A4
SCHEMBL27288543 0.85 MEN1 (0.43) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12487184 0.85 DRD2 (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17231550 0.85 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19172234 0.85 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16302999 0.85 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTHPGD

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-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 — — US disclosed
US-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 — — US disclosed
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