SCHEMBL16425644

SCHEMBL16425644

CCN(CCCN(C)C)c1ccc2c(-c3ccc(OC)cc3)c3ccc(=N)cc-3oc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ BLM P54132 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BCHE P06276 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ USP2 O75604 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ ATM Q13315 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ IGLV6-57 P01721 1/20 0.36

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
SCHEMBL16425650 0.90 MEN1 (0.41) MEN1KMT2ATDP1BLMTHRB
SCHEMBL16425645 0.89 KMT2A (0.51) MEN1KMT2ATDP1BLMTHRB
SCHEMBL16425646 0.88 MEN1 (0.40) MEN1KMT2ATDP1BLMTHRB
SCHEMBL16425649 0.86 IGLV6-57 (0.40) MEN1KMT2ATDP1BLMTHRB
SCHEMBL16425629 0.83 MEN1 (0.55) MEN1KMT2ATDP1BLMTHRB
SCHEMBL16425654 0.75 ABCB1 (0.58) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL3503594 0.70 MEN1 (0.72) MEN1KMT2ATDP1BLMTHRB
SCHEMBL12836995 0.70 ALDH1A1 (0.45) MEN1KMT2ATDP1BLMTHRB
SCHEMBL14724047 0.69 ABCB1 (0.52) MEN1KMT2ATDP1BLMTHRB
SCHEMBL10040697 0.69 ABCB1 (0.71) MEN1KMT2ABLMTHRBMAPT

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
US-9335323-B2 Method for sorting of pluripotent cells KYOTO UNIVERSITY (JP) 2016-05-10 — — US disclosed
US-20150031062-A1 METHOD FOR SORTING OF PLURIPOTENT CELLS KYOTO UNIVERSITY (JP) 2015-01-29 — — US disclosed
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