SCHEMBL6282103

SCHEMBL6282103

CS(=O)(=O)n1cc(C(=NNC(=N)N)C2CC2)c2ccc(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 10/20 0.41
PER2 O15055 4/20 0.32
CRY1 Q16526 4/20 0.32
CRY2 Q49AN0 4/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ASH1L Q9NR48 1/20 0.32
TPSAB1 Q15661 1/20 0.31
IDO1 P14902 1/20 0.30
TDO2 P48775 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
SCHEMBL6282097 1.00 HTR3A (0.41) HTR3APER2CRY1CRY2TP53
SCHEMBL6285611 0.87 HTR6 (0.42) SMN1; SMN2TPSAB1
SCHEMBL6285605 0.87 HTR6 (0.42) SMN1; SMN2TPSAB1
SCHEMBL6285344 0.86 PTGDR2 (0.35) HTR3A
SCHEMBL6285340 0.86 PTGDR2 (0.35) HTR3A
SCHEMBL6282971 0.85 HTR3A (0.47) HTR3ASMN1; SMN2TPSAB1
SCHEMBL6282976 0.85 HTR3A (0.47) HTR3ASMN1; SMN2TPSAB1
SCHEMBL6282001 0.85 HTR6 (0.42)
SCHEMBL6281998 0.85 HTR6 (0.42)
SCHEMBL6286951 0.84 HTR3A (0.38) HTR3APER2CRY1CRY2IDO1

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 11/4885PER2 1550/4885CRY1 2274/4885

“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.