SCHEMBL25791973

SCHEMBL25791973

CP(C)(=O)c1cccc(-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6cccc(-c7nc(-c8ccccc8)cc(-c8cccc(-c9c%10ccccc%10c(-c%10cccc(P(C)(C)=O)c%10)c%10ccccc9%10)c8)n7)c6)cc5)n4)cc3)c3ccccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.40
KMT2A Q03164 8/20 0.40
ALDH1A1 P00352 7/20 0.40
HPGD P15428 7/20 0.40
MAPT P10636 6/20 0.40
KDM4E B2RXH2 4/20 0.40
LMNA P02545 2/20 0.40
GLA P06280 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CYP2C19 P33261 1/20 0.38
TOP1 P11387 1/20 0.37
NTSR1 P30989 1/20 0.36
ACACA Q13085 2/20 0.34
PDE7A Q13946 3/20 0.33
PDE7B Q9NP56 3/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
DHODH Q02127 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL24098238 0.89 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL27398053 0.89 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24108475 0.88 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21881920 0.87 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24226052 0.85 L3MBTL1 (0.37) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL21881887 0.85 L3MBTL1 (0.39) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL30865645 0.85 L3MBTL1 (0.39) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21803702 0.85 L3MBTL1 (0.39) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL25787296 0.85 L3MBTL1 (0.39) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21881914 0.84 L3MBTL1 (0.38) MEN1KMT2AALDH1A1HPGDMAPT

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-20230225201-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2023-07-13 US disclosed