SCHEMBL9831465

SCHEMBL9831465

CNc1cnn(-c2ccc(C(F)(F)F)cc2)c(=O)c1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.71
SMN1; SMN2 Q16637 6/20 0.71
NPC1 O15118 6/20 0.71
CYP1A2 P05177 3/20 0.68
HTT P42858 3/20 0.68
CYP2C9 P11712 1/20 0.68
NPBWR1 P48145 2/20 0.52
MCHR1 Q99705 1/20 0.51
KAT2B Q92831 1/20 0.50
BRD9 Q9H8M2 1/20 0.50
ALDH1A1 P00352 6/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 1/20 0.48
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HIF1A Q16665 1/20 0.44
MAPT P10636 3/20 0.44
S1PR4 O95977 2/20 0.44

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
Norflurazone SCHEMBL6512279 0.85 CYP1A2 (0.66) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL29776940 0.85 CYP1A2 (0.66) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL54676 0.85 CYP1A2 (0.66) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL28530944 0.84 CYP1A2 (0.64) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL7039956 0.84 CYP1A2 (0.64) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL28173162 0.81 CYP1A2 (0.61) RAB9ASMN1; SMN2NPC1CYP1A2HTT
SCHEMBL4175570 0.81 RAB9A (0.64) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL27382340 0.79 CYP1A2 (0.61) RAB9ASMN1; SMN2NPC1CYP1A2HTT
Norflurazone SCHEMBL10870860 0.79 CYP1A2 (0.64) RAB9ASMN1; SMN2NPC1CYP1A2HTT
SCHEMBL26008538 0.78 RAB9A (0.71) RAB9ASMN1; SMN2NPC1CYP1A2HTT

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
EP-0133612-B1 SUBSTITUTED 2,6-SUBSTITUTED PYRIDINE COMPOUNDS MONSANTO COMPANY (US) 1991-02-27 EP disclosed
US-4581434-A USING DIFUNCTION COUPLING MEMBER TO LINK PESTICIDE TO A POLYETHER BAYER AKTIENGESELLSCHAFT (DE) 1986-04-08 US disclosed
US-4560738-A REACTION OF ACTIVE HYDROGEN PESTICIDE WITH POLYETHER ISOCYANATE BAYER AKTIENGESELLSCHAFT (DE) 1985-12-24 US disclosed
EP-0103776-A2 Compounds, process for their preparation and their application as pesticides with slow-release activity BAYER AG (DE) 1984-03-28 EP disclosed