SCHEMBL6287700

SCHEMBL6287700

CS(=O)(=O)n1cc(/C(=N\NC(=N)N)C2CC2)c2cc(Cl)ccc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 10/20 0.38
ACLY P53396 2/20 0.33
ALDH1A1 P00352 1/20 0.32
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
THRB P10828 1/20 0.32
HTR6 P50406 1/20 0.32
AHR P35869 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL6287704 1.00 HTR3A (0.38) HTR3AACLYALDH1A1TP53MAPT
SCHEMBL6278624 0.87 HTR6 (0.44) HTR6
SCHEMBL6278622 0.87 HTR6 (0.44) HTR6
SCHEMBL6282819 0.86 SLC6A9 (0.34) ACLYALDH1A1TP53MAPTHTR6
SCHEMBL6282816 0.86 SLC6A9 (0.34) ACLYALDH1A1TP53MAPTHTR6
SCHEMBL6282971 0.85 HTR3A (0.47) HTR3AHTR6
SCHEMBL6282976 0.85 HTR3A (0.47) HTR3AHTR6
SCHEMBL6278478 0.85 HTR6 (0.42) HTR6
SCHEMBL6278481 0.85 HTR6 (0.42) HTR6
SCHEMBL6281765 0.84 KDM1A (0.36) HTR3AACLYALDH1A1

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 HTR3A 11/4885ACLY 3246/4885ALDH1A1 757/4885

“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.