SCHEMBL6282805

SCHEMBL6282805

CCCCC(=NNC(=N)N)c1cn(S(=O)(=O)CCCC)c2cc(F)ccc12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.37
CNR1 P21554 5/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
HTR6 P50406 5/20 0.35
ICMT O60725 1/20 0.32
PCSK9 Q8NBP7 2/20 0.30
HTR7 P34969 1/20 0.30
PER2 O15055 1/20 0.30
CRY1 Q16526 1/20 0.30
CRY2 Q49AN0 1/20 0.30

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
SCHEMBL6282800 1.00 CNR2 (0.37) CNR2CNR1PTGDR2HTR6ICMT
SCHEMBL6286293 0.90 CNR2 (0.38) CNR2CNR1ICMTHTR7PER2
SCHEMBL6286290 0.90 CNR2 (0.38) CNR2CNR1ICMTHTR7PER2
SCHEMBL6282010 0.90 PTGDR2 (0.37) CNR2CNR1PTGDR2HTR6ICMT
SCHEMBL6282008 0.90 PTGDR2 (0.37) CNR2CNR1PTGDR2HTR6ICMT
SCHEMBL6285141 0.87 HTR6 (0.47) CNR2CNR1HTR6
SCHEMBL6285147 0.87 HTR6 (0.47) CNR2CNR1HTR6
SCHEMBL6285533 0.87 PLK1 (0.42) CNR2CNR1PTGDR2HTR6HTR7
SCHEMBL6285535 0.87 PLK1 (0.42) CNR2CNR1PTGDR2HTR6HTR7
SCHEMBL6285344 0.85 PTGDR2 (0.35) CNR2CNR1PTGDR2HTR6ICMT

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
US-6906095-B2 Indolylalkylidenehydrazine-carboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-06-14 US disclosed
US-20040002527-A1 Indolylalkylidenehydrazine-carboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH 2004-01-01 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-20040002527-A1 Indolylalkylidenehydrazine-carboximidamide derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR2A CNR2 28/4885CNR1 33/4885PTGDR2 208/4885

“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.