SCHEMBL11301231

SCHEMBL11301231

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Oc2ccc([N+](=O)[O-])cc2)c(Cl)c1

nearest known ligand 0.77

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.77
PNLIP P16233 8/20 0.63
KMT2A Q03164 8/20 0.59
MEN1 O00255 7/20 0.59
GAA P10253 3/20 0.59
PKM P14618 1/20 0.59
MAPT P10636 6/20 0.55
LMNA P02545 4/20 0.55
RAB9A P51151 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
HTT P42858 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
XBP1 P17861 1/20 0.55
CCR6 P51684 1/20 0.55
MAPK1 P28482 3/20 0.53
ALDH1A1 P00352 4/20 0.52
TDP1 Q9NUW8 2/20 0.52
NPC1 O15118 1/20 0.50
MYOC Q99972 1/20 0.50

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
SCHEMBL9135999 0.88 GCGR (0.58) GCGRPNLIPKMT2AMEN1GAA
SCHEMBL11141724 0.87 GCGR (0.87) GCGRPNLIPPKMRAB9ATDP1
SCHEMBL11140121 0.84 KMT2A (0.67) KMT2AMEN1GAAPKMMAPT
SCHEMBL11666311 0.83 GCGR (0.64) GCGRPNLIPKMT2AMEN1MAPT
SCHEMBL8661386 0.83 GCGR (0.87) GCGRPNLIPPKMRAB9ATDP1
SCHEMBL11007631 0.82 MEN1 (0.67) GCGRPNLIPKMT2AMEN1GAA
SCHEMBL11239734 0.81 KMT2A (0.58) GCGRPNLIPKMT2AMEN1GAA
SCHEMBL11239740 0.81 KMT2A (0.58) GCGRPNLIPKMT2AMEN1GAA
SCHEMBL4682789 0.80 MEN1 (0.68) PNLIPKMT2AMEN1GAAPKM
SCHEMBL4682794 0.80 MEN1 (0.68) PNLIPKMT2AMEN1GAAPKM

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
JP-56068659-A None JP disclosed
JP-S5668659-A N-BENZOYL-N'-PHENOXYPHENYLUREA COMPOUND, AND INSECTICIDE CONTAINING THE SAME ISHIHARA SANGYO KAISHA LTD 1981-06-09 JP disclosed