SCHEMBL21577617

SCHEMBL21577617

c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5c6ccccc6ccc54)cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.43
▸ MEN1 O00255 7/20 0.43
▸ MAPT P10636 7/20 0.43
▸ HPGD P15428 7/20 0.43
▸ ALDH1A1 P00352 6/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ KDM4E B2RXH2 5/20 0.40
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ PTGES O14684 2/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CYP1A1 P04798 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL13086753 1.00 KMT2A (0.43) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17943397 0.99 KMT2A (0.42) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL22223539 0.95 MAPT (0.40) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL22211945 0.95 MAPT (0.40) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL19428815 0.94 MAPT (0.39) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL19266949 0.94 MAPT (0.39) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17179109 0.93 HPGD (0.46) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17179018 0.93 HPGD (0.46) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL19266587 0.93 MAPT (0.40) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL19428814 0.93 MAPT (0.40) KMT2AMEN1MAPTHPGDALDH1A1

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
US-20190355912-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2019-11-21 — — US disclosed
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