SCHEMBL5709202

SCHEMBL5709202

Cn1cc(NC=O)cc1C=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.40
ATM Q13315 1/20 0.39
HRAS P01112 1/20 0.38
ESR1 P03372 1/20 0.38
TOP1 P11387 1/20 0.38
ESR2 Q92731 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HIF1A Q16665 1/20 0.37
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL12582112 0.82 ATM (0.40) HDAC8ATMTRIM24TRIM33
SCHEMBL18558714 0.76 ATM (0.43) HDAC8ATMKDM4EMAPTALDH1A1
SCHEMBL2072144 0.74 HDAC8 (0.58) HDAC8ATMKDM4EMAPTTRIM24
SCHEMBL28223520 0.73 HRAS (0.36) HRASESR1TOP1ESR2KDM4E
SCHEMBL5709196 0.73 HRAS (0.36) HRASESR1TOP1ESR2KDM4E
SCHEMBL13257099 0.73 ATM (0.35) HDAC8ATMTRIM24TRIM33
SCHEMBL4855585 0.72 HRAS (0.50) HDAC8HRASESR1TOP1ESR2
SCHEMBL4850168 0.71 HRAS (0.49) HDAC8HRASESR1TOP1ESR2
SCHEMBL16271028 0.70
SCHEMBL5400147 0.69 ATM (0.40) HDAC8ATMTRIM24TRIM33ALDH1A1

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
EP-1641753-B1 PROCESS FOR THE SYNTHESIS OF DISTAMYCIN AND DERIVATIVES THEREOF USING 1-METHYL-4-FORMYLAMINO-2-PYRROLECARBONYL CHLORIDE ITERATIVELY AS AN INTERMEDIATE NAXOSPHARMA S R L (IT) 2006-10-18 EP claimed