SCHEMBL18156544

SCHEMBL18156544

CC(F)(c1cc(I)c(NC(=O)c2cccc(N=O)c2F)c(I)c1)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 11/20 0.35
P2RX1 P51575 3/20 0.33
P2RX7 Q99572 1/20 0.33
KDM4E B2RXH2 2/20 0.32
UGCG Q16739 1/20 0.32
HPGD P15428 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
PPARG P37231 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
CTSS P25774 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL12649005 0.89 RXFP1 (0.37) RXFP1P2RX1P2RX7KDM4ETRPV1
SCHEMBL18156555 0.88 TRPV1 (0.36) RXFP1P2RX1P2RX7TRPV1CTSS
SCHEMBL18156582 0.87 SMN1; SMN2 (0.35) RXFP1P2RX1P2RX7KDM4EUGCG
SCHEMBL18156554 0.84 PTGS1 (0.42) RXFP1P2RX1P2RX7KDM4EUGCG
SCHEMBL18156559 0.81 RXFP1 (0.32) RXFP1P2RX1P2RX7
SCHEMBL18156541 0.81 RXFP1 (0.48) RXFP1PPARGNR1H4
SCHEMBL12658709 0.78 POLB (0.40) RXFP1P2RX1P2RX7KDM4EALDH1A1
SCHEMBL12648899 0.76 TRPV1 (0.37) RXFP1P2RX1P2RX7KDM4ETRPV1
SCHEMBL12648813 0.75 SMN1; SMN2 (0.36) RXFP1P2RX1P2RX7KDM4EHPGD
SCHEMBL15242253 0.74 P2RX1 (0.43) RXFP1P2RX1P2RX7KDM4EALDH1A1

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-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