SCHEMBL18156548

SCHEMBL18156548

O=Nc1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)C(F)(F)F)cc2Br)c1F

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
RXFP1 Q9HBX9 4/20 0.34
F2R P25116 1/20 0.33
P2RX1 P51575 5/20 0.33
P2RX7 Q99572 3/20 0.33
MEN1 O00255 1/20 0.33
OPRK1 P41145 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
DHODH Q02127 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
PTGS1 P23219 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
P2RX4 Q99571 2/20 0.30
TMPRSS4 Q9NRS4 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
SCHEMBL12648813 0.94 SMN1; SMN2 (0.36) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL12649006 0.88 SMN1; SMN2 (0.34) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL14140871 0.87 SMN1; SMN2 (0.38) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL19240551 0.86 SMN1; SMN2 (0.33) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL18156582 0.86 SMN1; SMN2 (0.35) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL15242246 0.84 P2RX1 (0.40) SMN1; SMN2RXFP1F2RP2RX1MEN1
SCHEMBL1766729 0.84 PTGS1 (0.41) SMN1; SMN2RXFP1F2RP2RX1P2RX7
SCHEMBL1767106 0.83 RXFP1 (0.39) SMN1; SMN2RXFP1F2RMEN1OPRK1
SCHEMBL13977832 0.83 HTT (0.38) SMN1; SMN2RXFP1P2RX1P2RX7MEN1
SCHEMBL12659194 0.82 SMN1; SMN2 (0.36) SMN1; SMN2RXFP1F2RP2RX1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3081552-B1 PEST CONTROL AGENT CONTAINING AN AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT MITSUI CHEMICALS AGRO INC (JP) 2021-03-03 EP disclosed
EP-3205642-A2 AMIDE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE AMIDE DERIVATIVE AND PEST CONTROLLING METHOD Mitsui Chemicals Agro, Inc. (JP) 2017-08-16 EP disclosed
EP-3081552-A1 PEST CONTROL AGENT CONTAINING AN AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT Mitsui Chemicals Agro, Inc. (JP) 2016-10-19 EP disclosed