SCHEMBL17099641

SCHEMBL17099641

Cc1cc(C)c(CNC(=O)c2csc(CCCN3CCC(N(C)C)CC3)c2C)c(=O)[nH]1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EED O75530 20/20 0.75
RBBP4 Q09028 20/20 0.75
SUZ12 Q15022 20/20 0.75
EZH2 Q15910 20/20 0.75
AEBP2 Q6ZN18 20/20 0.75

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
SCHEMBL17099648 0.96 EED (0.71) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212664 0.87 EZH2 (0.70) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212464 0.86 EZH2 (0.68) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL17713628 0.86 EZH2 (0.68) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212636 0.86 EZH2 (0.68) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212989 0.86 EED (1.00) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212987 0.86 EED (1.00) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL16212990 0.86 EED (1.00) EEDRBBP4SUZ12EZH2AEBP2
Formic Acid SCHEMBL16212829 0.84 EED (0.96) EEDRBBP4SUZ12EZH2AEBP2
Formic Acid SCHEMBL16212827 0.84 EED (0.96) EEDRBBP4SUZ12EZH2AEBP2

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
EP-3119390-A2 METHODS OF TREATING CANCER Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2017-01-25 EP disclosed
WO-2015143424-A2 METHODS OF TREATING CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2015-09-24 WO disclosed