SCHEMBL9704756

SCHEMBL9704756

O=CC=NNc1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
OPRK1 P41145 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GPR35 Q9HC97 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
SRC P12931 1/20 0.33
BRAF P15056 1/20 0.33
KDR P35968 1/20 0.33
HPGD P15428 4/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 3/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 4/20 0.32
CYP3A4 P08684 2/20 0.32

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
SCHEMBL9704751 1.00 KDM4E (0.36) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL9768331 0.82 KDM4E (0.35) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL9768328 0.82 KDM4E (0.35) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL10569762 0.79 SRC (0.35) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL7711320 0.78 TDP1 (0.41) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL9397605 0.74 TDP1 (0.36) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL5744936 0.73 MRGPRX4 (0.34) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL5744932 0.73 MRGPRX4 (0.34) KDM4EKMT2AMEN1NPC1OPRK1
SCHEMBL25340703 0.73 NPSR1 (0.46) KMT2AMEN1NPC1HTTRAB9A
SCHEMBL7603528 0.73 KMT2A (0.36) KDM4EKMT2AHTTGPR35TDP1

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
WO-1992013451-A1 IMIDAZOLE PESTICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-08-20 WO disclosed
US-5064844-A Miticides SCHERING AGROCHEMICALS LIMITED (GB) 1991-11-12 US disclosed
CN-1039345-A TRIAZOLE INSECTICIDES SCHERING AGROCHEMICALS LTD (GB) 1990-02-07 CN disclosed
EP-0350237-A2 Triazole insecticides SCHERING AGROCHEMICALS LIMITED (GB) 1990-01-10 EP disclosed