SCHEMBL20076423

SCHEMBL20076423

C=C(Nc1ccc(F)c(N)c1F)c1cc(C)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 4/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
HTT P42858 1/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
ALDH1A1 P00352 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
F10 P00742 2/20 0.34
THRB P10828 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33

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
SCHEMBL20076380 0.86 MEN1 (0.35) KDM4ERAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL21019686 0.86 RAB9A (0.42) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL21021625 0.85 RAB9A (0.41) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL21021523 0.84 RAB9A (0.40) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL20076766 0.84 KDM4E (0.41) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL20076969 0.83 ALDH1A1 (0.32) KDM4ERAB9ASMN1; SMN2NPC1LMNA
SCHEMBL21021365 0.81 MEN1 (0.37) KDM4ERAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL20076783 0.81 KDM4E (0.37) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL20076509 0.80 KDM4E (0.36) KDM4ERAB9APPARGPPARASMN1; SMN2
SCHEMBL20077004 0.80 KDM4E (0.36) KDM4ERAB9APPARGPPARASMN1; SMN2

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed
WO-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed