SCHEMBL19987537

SCHEMBL19987537

COc1c(C=O)c(-c2ccc(OCc3ccccc3N(N)C(=O)NN)c(C)c2)nn1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.33
HPGD P15428 5/20 0.32
ALDH1A1 P00352 5/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
CD274 Q9NZQ7 2/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTT P42858 1/20 0.32
PKM P14618 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 4/20 0.32
MAPT P10636 1/20 0.32
MMP1 P03956 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
LMNA P02545 2/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL19987559 0.89 MRGPRX4 (0.34) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL19987585 0.85 HPGD (0.35) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL19987547 0.80 HPGD (0.35) KDM4EHPGDALDH1A1KMT2AMEN1
SCHEMBL17600113 0.77 KDM4E (0.34) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL19987602 0.76 CD274 (0.33) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL19987563 0.75 MRGPRX4 (0.44) HPGDALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL19987543 0.72 MAOB (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1CD274
SCHEMBL19987560 0.71 CD274 (0.35) HPGDCD274MMP1MMP9MMP8
SCHEMBL16273662 0.70 HPGD (0.36) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A
SCHEMBL18433815 0.70 SMN1; SMN2 (0.40) KDM4EHPGDALDH1A1SMN1; SMN2KMT2A

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-3006440-B1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL CO (JP) 2018-03-21 EP disclosed