SCHEMBL8876099

SCHEMBL8876099

Cn1nc(-c2ccccc2Cl)nc1-c1cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)ccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.38
PDE2A O00408 6/20 0.37
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PDE10A Q9Y233 2/20 0.35
MAT2A P31153 1/20 0.34
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MET P08581 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
SCHEMBL8876286 0.86 HSD11B1 (0.35) HSD11B1PDE2ANR1H2NR1H3PDE10A
SCHEMBL8875393 0.85 HSD11B1 (0.36) HSD11B1PDE2ANR1H2NR1H3PDE10A
SCHEMBL8304887 0.76 HSD11B1 (0.55) HSD11B1NR1H2NR1H3NPC1RAB9A
SCHEMBL9705543 0.74 HSD11B1 (0.62) HSD11B1
SCHEMBL10939886 0.73 HSD11B1 (0.46) HSD11B1NR1H2NR1H3NPC1RAB9A
SCHEMBL4611901 0.72 HSD11B1 (0.56) HSD11B1NR1H2NR1H3
SCHEMBL9830823 0.72 HSD11B1 (0.62) HSD11B1
SCHEMBL4611822 0.72 NR1H2 (0.47) HSD11B1PDE2ANR1H2NR1H3NPC1
SCHEMBL9830131 0.71 HSD11B1 (0.52) HSD11B1
SCHEMBL8303627 0.71 HSD11B1 (0.45) HSD11B1NR1H2NR1H3NPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5700824-A Triazole derivatives, insecticide, acaricide and methods thereof KUMIAI CHEMICAL INDUSTRIAL CO. LTD. (JP) 1997-12-23 US disclosed
US-5616594-A Triazole derivatives, insecticide, acaricide and methods thereof IHARA CHEMICAL INDUSTRY CO. LTD. (JP) 1997-04-01 US disclosed
EP-0648752-A1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-19 EP disclosed