SCHEMBL18071069

SCHEMBL18071069

CC(=O)N(C(C)=O)c1ccc(-c2ccc(N(C(C)=O)C(C)=O)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
HSD17B10 Q99714 2/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 1/20 0.35
NSD2 O96028 1/20 0.33
GAA P10253 1/20 0.32
ENPP2 Q13822 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30
ACLY P53396 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL18068785 0.90 MAPK10 (0.34) CRHBPCRHR2HSD17B10POLBNPSR1
SCHEMBL345228 0.84 PDK2 (0.43) HSD17B10POLBKMT2ANSD2ALDH1A1
SCHEMBL21628088 0.75 ALDH1A1 (0.49) HSD17B10POLBKMT2AGAAALDH1A1
SCHEMBL17086600 0.72 TGM2 (0.41) NSD2
SCHEMBL11238331 0.71 CRHBP (0.47) CRHBPCRHR2HSD17B10KMT2ANSD2
SCHEMBL803612 0.71 GAA (0.48) CRHBPCRHR2HSD17B10POLBNPSR1
SCHEMBL361092 0.69 MAOA (0.45) HSD17B10POLBKMT2AGAAALDH1A1
SCHEMBL10398568 0.68 CRHBP (0.65) CRHBPCRHR2HSD17B10POLBNPSR1
SCHEMBL11504757 0.67 PKM (0.48) HSD17B10POLBKMT2AGAAALDH1A1
SCHEMBL11800568 0.67 KDM4E (0.52) CRHBPCRHR2HSD17B10POLBNPSR1

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-20160266292-A1 Coatable Polymer Polarizer LIGHT POLYMERS HOLDING (KY) 2016-09-15 US disclosed