SCHEMBL6404070

SCHEMBL6404070

Fc1ccc(CSc2nnc(-c3ccc(OC(F)(F)F)cc3)[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.49
HTT P42858 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
GRK6 P43250 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
MAPK14 Q16539 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 2/20 0.37
MAOB P27338 1/20 0.37
CTSB P07858 1/20 0.37
FABP3 P05413 1/20 0.37
FABP4 P15090 1/20 0.37
SCN10A Q9Y5Y9 1/20 0.36

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
SCHEMBL6411081 0.85 SCN9A (0.47) SCN9ARAB9ALMNAGRK6POLB
SCHEMBL6404365 0.78 GRK6 (0.40) SCN9AGRK6SCN10A
SCHEMBL5764870 0.77 SCN9A (0.53) SCN9AHTTNPC1RAB9ASMN1; SMN2
SCHEMBL6408622 0.77 GRK6 (0.62) SCN9AGRK6TP53POLBSCN10A
SCHEMBL6411809 0.77 GRK6 (0.40) SCN9AGRK6MAOBSCN10A
SCHEMBL16171132 0.76 GRK6 (0.49) SCN9AGRK6TP53POLBSCN10A
SCHEMBL6405373 0.71 GSK3A (0.50) NPC1RAB9ASMN1; SMN2LMNAMAPK14
SCHEMBL25260119 0.70 SCN10A (0.47) SCN9AGRK6SCN10A
SCHEMBL6410739 0.69 LMNA (0.46) NPC1RAB9ASMN1; SMN2LMNATP53
SCHEMBL10171990 0.68 SCN10A (0.45) SCN9AGRK6SCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof ABCG2, ATP5ME, DNTT SCN9A 4476/4885HTT 2113/4885NPC1 2070/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.