SCHEMBL6285340

SCHEMBL6285340

CCCCS(=O)(=O)n1cc(/C(=N\NC(=N)N)C2CC2)c2ccc(F)cc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.35
CNR1 P21554 5/20 0.33
CNR2 P34972 4/20 0.33
NPC1 O15118 1/20 0.31
HTR6 P50406 2/20 0.31
HTR3A P46098 2/20 0.31
ICMT O60725 1/20 0.30
DRD2 P14416 1/20 0.30
SLC6A4 P31645 1/20 0.30
HRH2 P25021 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
SCHEMBL6285344 1.00 PTGDR2 (0.35) PTGDR2CNR1CNR2NPC1HTR6
SCHEMBL6281786 0.87 HTR6 (0.43) CNR1CNR2NPC1HTR6HTR3A
SCHEMBL6281788 0.87 HTR6 (0.43) CNR1CNR2NPC1HTR6HTR3A
SCHEMBL6282010 0.86 PTGDR2 (0.37) PTGDR2CNR1CNR2HTR6ICMT
SCHEMBL6282008 0.86 PTGDR2 (0.37) PTGDR2CNR1CNR2HTR6ICMT
SCHEMBL6282103 0.86 HTR3A (0.41) HTR3A
SCHEMBL6282097 0.86 HTR3A (0.41) HTR3A
SCHEMBL6282805 0.85 CNR2 (0.37) PTGDR2CNR1CNR2HTR6ICMT
SCHEMBL6282800 0.85 CNR2 (0.37) PTGDR2CNR1CNR2HTR6ICMT
SCHEMBL6282816 0.84 SLC6A9 (0.34) CNR1CNR2HTR6

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 PTGDR2 208/4885CNR1 33/4885CNR2 28/4885

“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.