SCHEMBL9325879

SCHEMBL9325879

O=C(NC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1)NC(=O)c1ccccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.69
TDP1 Q9NUW8 2/20 0.62
PNLIP P16233 8/20 0.56
RORC P51449 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
FFAR1 O14842 2/20 0.47
STK39 Q9UEW8 1/20 0.47
MEN1 O00255 1/20 0.47
TTR P02766 1/20 0.47
PPOX P50336 1/20 0.47
KMT2A Q03164 1/20 0.47
TLR8 Q9NR97 1/20 0.46
TLR7 Q9NYK1 1/20 0.46

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
SCHEMBL8659897 0.98 GCGR (0.72) GCGRTDP1PNLIPRORCNPSR1
SCHEMBL10418185 0.88 PNLIP (0.58) GCGRTDP1PNLIPNPSR1FFAR1
SCHEMBL9326642 0.87 GCGR (0.54) GCGRTDP1PNLIPNPSR1MEN1
SCHEMBL8662539 0.86 GCGR (0.65) GCGRTDP1PNLIPSTK39
SCHEMBL10746663 0.86 GCGR (0.55) GCGRTDP1PNLIP
SCHEMBL8661106 0.86 GCGR (0.64) GCGRTDP1PNLIPSTK39
SCHEMBL8658021 0.86 GCGR (0.60) GCGRTDP1PNLIPRORCNPSR1
SCHEMBL10418187 0.85 MRGPRX4 (0.54) GCGRTDP1PNLIPNPSR1FFAR1
SCHEMBL11303176 0.85 GCGR (0.59) GCGRTDP1PNLIPRORCNPSR1
SCHEMBL9324671 0.85 TLR8 (0.57) GCGRPNLIPFFAR1STK39MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155135-A Insecticides, miticides SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ, B.V. (NL) 1992-10-13 US claimed
EP-0375069-B1 Benzamide compounds, their preparation and their use as pesticides SHELL INT RESEARCH (NL) 1994-03-09 EP disclosed
US-5155135-A Insecticides, miticides SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ, B.V. (NL) 1992-10-13 US disclosed
EP-0375069-A1 Benzamide compounds, their preparation and their use as pesticides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-27 EP disclosed