SCHEMBL27360056

SCHEMBL27360056

CC1(C)OB(c2ccccc2-c2nc(-c3ccccc3)c3ccccc3n2)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ ATM Q13315 1/20 0.45
▸ NUDT1 P36639 3/20 0.43
▸ ADORA2A P29274 3/20 0.40
▸ LPL P06858 1/20 0.40
▸ LIPG Q9Y5X9 1/20 0.40
▸ MAPT P10636 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ WHR1 P49842 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ RAD52 P43351 1/20 0.35
▸ LMNA P02545 2/20 0.35

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
SCHEMBL24149672 0.91 MEN1 (0.51) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23105659 0.90 MEN1 (0.45) MEN1KMT2AATMADORA2ALPL
SCHEMBL17412541 0.89 MEN1 (0.44) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL27454034 0.85 LPL (0.43) MEN1KMT2AATMLPLLIPG
SCHEMBL27296257 0.85 MEN1 (0.39) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL23105506 0.83 MEN1 (0.41) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL17529962 0.82 LPL (0.47) MEN1KMT2AATMADORA2ALPL
SCHEMBL23327871 0.81 LIPG (0.54) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL17412542 0.81 MEN1 (0.42) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18018261 0.81 TSHR (0.41) MEN1KMT2AADORA2ALPLLIPG

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
WO-2024053991-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-03-14 — — WO disclosed
WO-2024054010-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-03-14 — — WO disclosed
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