SCHEMBL6208730

SCHEMBL6208730

Cc1nnsc1-c1nc(-c2c(F)cccc2Cl)nn1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.39
PDE10A Q9Y233 2/20 0.39
ATM Q13315 1/20 0.38
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 3/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
PTGES O14684 1/20 0.32
MEN1 O00255 1/20 0.32
CHRNB2 P17787 1/20 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
SCHEMBL6208551 0.91 NR1H2 (0.36) PDE2APDE10AATMNR1H2NR1H3
SCHEMBL6209661 0.82 PDE2A (0.37) PDE2APDE10AATMHTTLMNA
SCHEMBL5202844 0.80 PDE2A (0.35) PDE2APDE10AHTTLMNAMAPK1
SCHEMBL5202950 0.80 HTT (0.36) PDE2APDE10AATMHTTLMNA
SCHEMBL6976749 0.80 PDE2A (0.35) PDE2APDE10AHTTLMNAMAPK1
SCHEMBL7527087 0.80 PDE2A (0.35) PDE2APDE10AHTTLMNAMAPK1
SCHEMBL6972041 0.78 PDE2A (0.34) PDE2APDE10AATMHTTLMNA
SCHEMBL7526323 0.78 PDE2A (0.34) PDE2APDE10AHTTLMNAMAPK1
SCHEMBL2933280 0.78 PDE2A (0.34) PDE2APDE10AATMHTTLMNA
SCHEMBL5726642 0.77 PDE2A (0.33) PDE2APDE10AHTTLMNAMAPK1

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-1124827-B1 3-(SUBSTITUTED PHENYL)-5-(SUBSTITUTED HETEROCYCLYL)-1,2,4-TRIAZOLE COMPOUNDS DOW AGROSCIENCES LLC (US) 2005-11-30 EP disclosed
US-6413997-B1 INSECTICIDES, MITICIDES DOW AGROSCIENCES LLC 2002-07-02 US disclosed