SCHEMBL6287004

SCHEMBL6287004

CCCCC(=NNC(=N)N)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.55
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TNF P01375 5/20 0.46
HTR6 P50406 7/20 0.46
AKR1C3 P42330 1/20 0.45
AKR1C1 Q04828 1/20 0.45
TNFSF11 O14788 3/20 0.44
ALOX5 P09917 2/20 0.44
PTGS2 P35354 1/20 0.44
DRD2 P14416 1/20 0.41
HTR2A P28223 1/20 0.41
HTR7 P34969 1/20 0.41

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
SCHEMBL6286997 1.00 PLK1 (0.55) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6286252 0.91 HTR6 (0.50) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6286257 0.91 HTR6 (0.50) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6278768 0.89 TNFSF11 (0.46) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6277929 0.89 PLK1 (0.42) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6277928 0.89 PLK1 (0.42) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6285533 0.89 PLK1 (0.42) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6278766 0.89 TNFSF11 (0.46) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6285535 0.89 PLK1 (0.42) PLK1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6286703 0.89 HTR3A (0.40) PLK1LMNASMN1; SMN2MEN1KMT2A

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 4 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 claimed
US-20040002527-A1 Indolylalkylidenehydrazine-carboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH 2004-01-01 US claimed
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 PLK1 2857/4885LMNA 4212/4885SMN1; SMN2 3120/4885

“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.