SCHEMBL14374079

SCHEMBL14374079

CCOC(=O)/C(Nc1ccccc1)=C(/Nc1ccc2c(c1)[nH]c(=O)n2CC)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ ALDH1A1 P00352 5/20 0.42
▸ MAPT P10636 6/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ PPARG P37231 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NCOA2 Q15596 1/20 0.42
▸ NCOA1 Q15788 1/20 0.42
▸ RORC P51449 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ DHODH Q02127 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 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
SCHEMBL14347592 1.00 KMT2A (0.46) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL14374465 0.91 KMT2A (0.43) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL14347625 0.91 KMT2A (0.43) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL6745420 0.78 ERCC1 (0.54) KMT2AMEN1CYP1A2ALDH1A1NPSR1
SCHEMBL13381411 0.76 ALDH1A1 (0.56) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL10386822 0.75 KDM4E (0.57) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL14375950 0.72 KDM4E (0.42) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL3196733 0.72 ALDH1A1 (0.52) KMT2AMEN1CYP1A2ALDH1A1MAPT
SCHEMBL14347613 0.71 KDM4E (0.49) KMT2ACYP1A2ALDH1A1MAPTKDM4E
SCHEMBL13381409 0.71 MAPT (0.68) KMT2AMEN1ALDH1A1MAPTKDM4E

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-7307170-B2 Epindolidione pigments CLARIANT FINANCE (BVI) LIMITED (VG) 2007-12-11 — — US disclosed
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