SCHEMBL25569099

SCHEMBL25569099

c1ccc(C2(c3ccc(Nc4ccc(-c5cccc6ccccc56)cc4)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ PPARG P37231 7/20 0.39
▸ PPARA Q07869 7/20 0.39
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL29632957 0.92 PDK2 (0.43) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL16017109 0.92 PDK2 (0.43) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL25569225 0.91 PDK2 (0.42) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL26006825 0.86 MEN1 (0.42) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL21214788 0.86 ALDH1A1 (0.43) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL29726730 0.86 ALDH1A1 (0.43) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL1644706 0.84 ALDH1A1 (0.58) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL30133699 0.84 MEN1 (0.50) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL22920781 0.84 MAPT (0.50) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL17805153 0.84 MEN1 (0.50) MEN1KMT2APOLBKDM4EMAPT

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-2023096209-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-01 — — WO disclosed
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