SCHEMBL14357408

SCHEMBL14357408

Cc1nc(C)nc(Nc2ccc(/N=N/c3ccc4ccccc4c3)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.49
▸ KMT2A Q03164 8/20 0.49
▸ NPC1 O15118 8/20 0.49
▸ RAB9A P51151 8/20 0.49
▸ HSP90AA1 P07900 3/20 0.49
▸ L3MBTL1 Q9Y468 4/20 0.41
▸ GAA P10253 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MAPT P10636 4/20 0.40
▸ MAPK1 P28482 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ LMNA P02545 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ IGF1R P08069 1/20 0.39

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
SCHEMBL14593253 0.91 RAB9A (0.48) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL6123868 0.86 MAPT (0.45) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL6123694 0.83 KCNH3 (0.46) MEN1KMT2ANPC1RAB9AGAA
SCHEMBL14189802 0.83 KCNH3 (0.46) MEN1KMT2ANPC1RAB9AGAA
SCHEMBL14280919 0.82 MAPT (0.56) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL12301036 0.77 KMT2A (0.46) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL13201663 0.77 KMT2A (0.46) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL14280917 0.76 MEN1 (0.59) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL13797736 0.76 MEN1 (0.59) MEN1KMT2ANPC1RAB9AHSP90AA1
SCHEMBL13797706 0.75 MEN1 (0.41) MEN1KMT2ANPC1RAB9AHSP90AA1

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-7297200-B2 Water-soluble yellow azo dyes CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2007-11-20 — — US disclosed
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