SCHEMBL14598293

SCHEMBL14598293

CN(O)c1nc(NCCCNC(=O)Nc2cccc(-n3c(S)nnc3S)c2)nc(N(C)O)n1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 1/20 0.38
▸ BRD4 O60885 2/20 0.37
▸ EPHX1 P07099 4/20 0.37
▸ ATM Q13315 4/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ EPHX2 P34913 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALOX15 P16050 1/20 0.35

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
SCHEMBL14360469 0.79 TSHR (0.34) KMT2APKMMAPT
SCHEMBL14093854 0.73 KMT2A (0.36) BRD4EPHX1ALDH1A1L3MBTL1KMT2A
SCHEMBL13656906 0.72 POLB (0.42) KMT2AMEN1
SCHEMBL13297738 0.70 POLB (0.42) ALDH1A1KMT2AMEN1MAPT
SCHEMBL14093923 0.69 ALDH1A1 (0.50) ALDH1A1L3MBTL1HSD17B10MAPT
SCHEMBL13297725 0.69 EPHX1 (0.41) EPHX1ATMALDH1A1L3MBTL1KMT2A
SCHEMBL14093868 0.68 CNR1 (0.39) ALDH1A1L3MBTL1KMT2APKMMEN1
SCHEMBL14344015 0.66 POLB (0.41) ALDH1A1L3MBTL1KMT2AMEN1MAPT
SCHEMBL14359778 0.65 TERT (0.46) ALDH1A1KMT2APKMMEN1MAPT
SCHEMBL14498660 0.65 EPHX1 (0.57) EPHX1ALDH1A1EPHX2

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-7157218-B2 Suppressed fogging and printout and is excellent in storage stability of an image against stain FUJIFILM CORPORATION (JP) 2007-01-02 — — US disclosed
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