SCHEMBL11142879

SCHEMBL11142879

COc1cc(N=Nc2ccc(N=Nc3cc(OC)c(N=Nc4cc(OC)c(N=Nc5cc(OC)c(N)cc5OC)cc4C)cc3C)cc2)c(OC)cc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ MAPT P10636 6/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ MAPK1 P28482 6/20 0.42
▸ L3MBTL1 Q9Y468 5/20 0.42
▸ PKM P14618 3/20 0.42
▸ ATM Q13315 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ BRD4 O60885 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
SCHEMBL11143616 0.93 MEN1 (0.48) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL16684222 0.89 MAPT (0.56) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL11649155 0.89 MEN1 (0.43) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL11649148 0.89 MEN1 (0.43) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL30880426 0.88 MEN1 (0.51) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL2027082 0.88 MEN1 (0.51) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL16684228 0.88 L3MBTL1 (0.54) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL2027081 0.88 MEN1 (0.51) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL10880502 0.87 MEN1 (0.47) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL10880497 0.87 MEN1 (0.47) MEN1KMT2AMAPTNPC1RAB9A

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-4401369-A NEMATIC HOST, CHOLESTERIC COMPONENT AND TETRAKISAZO DYE ELECTRONIC DISPLAY SYSTEMS, INC. (US) 1983-08-30 — — US disclosed
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