SCHEMBL23602702

SCHEMBL23602702

c1ccc(-c2cc(-c3ccc4oc5cc(-c6ccccc6)c6ccccc6c5c4c3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.45
▸ MEN1 O00255 7/20 0.45
▸ MAPT P10636 7/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ HPGD P15428 6/20 0.45
▸ NTSR1 P30989 1/20 0.45
▸ KDM4E B2RXH2 4/20 0.43
▸ LMNA P02545 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ ACACA Q13085 3/20 0.42
▸ ADORA2A P29274 1/20 0.40
▸ ADORA1 P30542 1/20 0.40
▸ MAPK1 P28482 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ WEE1 P30291 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MAOA P21397 2/20 0.37

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
SCHEMBL27352754 0.94 MEN1 (0.42) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL22174942 0.94 KMT2A (0.42) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL23602547 0.92 WEE1 (0.41) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL21019368 0.89 KMT2A (0.45) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL21019357 0.89 KMT2A (0.45) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL24586407 0.86 PLA2G2A (0.42) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL9889858 0.86 MEN1 (0.50) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL9920521 0.85 MEN1 (0.56) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL23602496 0.85 PLA2G2A (0.41) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL24216859 0.85 MEN1 (0.46) KMT2AMEN1MAPTALDH1A1HPGD

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-2021132995-A1 ORGANIC LIGHT-EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER THEREOF 엘티소재주식회사 2021-07-01 — — WO disclosed
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