SCHEMBL13508300

SCHEMBL13508300

CNc1cccc(C(=O)Nc2c(C)cc(C(F)(C(F)(F)F)C(F)(F)C(F)(F)F)cc2C(F)(F)F)c1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 6/20 0.39
LCK P06239 2/20 0.38
MAPK14 Q16539 2/20 0.38
KDR P35968 1/20 0.38
P2RX1 P51575 1/20 0.37
PTGES O14684 3/20 0.37
BRAF P15056 1/20 0.37
ALDH1A1 P00352 1/20 0.36
ALOX12 P18054 1/20 0.36
GAA P10253 1/20 0.35
CTSS P25774 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNK3 O14649 1/20 0.35
KCNK9 Q9NPC2 1/20 0.35
HTT P42858 1/20 0.34

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
SCHEMBL12440630 0.95 RXFP1 (0.41) RXFP1LCKMAPK14KDRP2RX1
SCHEMBL2106043 0.93 RXFP1 (0.40) RXFP1LCKMAPK14KDRP2RX1
SCHEMBL19240741 0.91 RXFP1 (0.37) RXFP1LCKMAPK14KDRPTGES
SCHEMBL1766875 0.90 RXFP1 (0.39) RXFP1LCKMAPK14KDRPTGES
SCHEMBL1842740 0.87 RXFP1 (0.42) RXFP1LCKMAPK14KDRP2RX1
SCHEMBL23543127 0.86 RXFP1 (0.41) RXFP1LCKMAPK14KDRP2RX1
SCHEMBL29549709 0.84 RXFP1 (0.40) RXFP1LCKMAPK14KDRPTGES
SCHEMBL1766517 0.84 RXFP1 (0.40) RXFP1LCKMAPK14KDRPTGES
SCHEMBL29634361 0.84 SMN1; SMN2 (0.43) RXFP1LCKMAPK14KDRPTGES
SCHEMBL1766396 0.84 SMN1; SMN2 (0.43) RXFP1LCKMAPK14KDRPTGES

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
WO-2010018714-A1 AMIDE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT 三井化学アグロ株式会社 (JP) 2010-02-18 WO disclosed