SCHEMBL3787295

SCHEMBL3787295

O=C1NC(=Cc2cccc([N+](=O)[O-])c2)C(=O)S1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.71
MEN1 O00255 6/20 0.63
KMT2A Q03164 6/20 0.63
MAPT P10636 4/20 0.60
ALDH1A1 P00352 2/20 0.60
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
METAP1 P53582 1/20 0.57
GAA P10253 1/20 0.54
NR1H4 Q96RI1 1/20 0.50
CYP19A1 P11511 1/20 0.50
HPGD P15428 1/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
NFE2L2 Q16236 2/20 0.48
POLB P06746 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
CASP3 P42574 1/20 0.47
BLM P54132 1/20 0.47
SENP8 Q96LD8 1/20 0.47

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
SCHEMBL13846818 0.83 IGF1R (1.00) IGF1RMEN1KMT2AMAPTALDH1A1
SCHEMBL1250598 0.83 IGF1R (1.00) IGF1RMEN1KMT2AMAPTALDH1A1
SCHEMBL1250596 0.83 IGF1R (1.00) IGF1RMEN1KMT2AMAPTALDH1A1
SCHEMBL7463867 0.78 PIM1 (0.68) IGF1RCSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL4014115 0.77 MEN1 (1.00) IGF1RMEN1KMT2AMAPTALDH1A1
SCHEMBL4014118 0.77 MEN1 (1.00) IGF1RMEN1KMT2AMAPTALDH1A1
SCHEMBL7464574 0.77 PIM1 (0.68) IGF1RMAPTHPGDHTTCSNK2A2
SCHEMBL4156417 0.75 CSNK2A2 (0.65) MEN1KMT2AMAPTHPGDLMNA
SCHEMBL7459912 0.73 GSK3B (0.71) IGF1RMAPTLMNACSNK2A2CLK1
SCHEMBL7466029 0.73 CSNK2A1 (0.71) MEN1KMT2AMAPTALDH1A1HPGD

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
WO-2010082212-A2 N-BIPHENYLACYL THIAZOLIDINE-2,4-DIONE DERIVATIVES, THEIR SYNTHESIS AND USES ELDER PHARMACEUTICALS LTD (IN) 2010-07-22 WO disclosed