SCHEMBL4628745

SCHEMBL4628745

CN(C)CCCN=C(N)NC(=O)c1cccs1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 7/20 0.65
SCN2A Q99250 7/20 0.65
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
KDM4E B2RXH2 1/20 0.43
TSHR P16473 2/20 0.43
MALT1 Q9UDY8 1/20 0.43
HDAC1 Q13547 1/20 0.42
GAA P10253 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HDAC3 O15379 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
KCNH2 Q12809 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL4628448 0.79 SCN5A (1.00) SCN5ASCN2ANPC1
SCHEMBL4628444 0.78 SCN5A (0.70) SCN5ASCN2ARAB9ANPC1KDM4E
SCHEMBL4628471 0.77 SCN5A (0.84) SCN5ASCN2ARAB9ANPC1KDM4E
SCHEMBL4629039 0.75 SCN2A (0.73) SCN5ASCN2A
SCHEMBL12181413 0.74 KDM4E (0.73) RAB9ANPC1KDM4ETSHRGAA
SCHEMBL4629281 0.74 SCN2A (0.71) SCN5ASCN2ARAB9ANPC1KDM4E
SCHEMBL4628740 0.73 KDM4E (0.55) RAB9ANPC1KDM4ETSHRHDAC1
SCHEMBL4629230 0.73 SCN5A (0.68) SCN5ASCN2AMEN1KMT2A
SCHEMBL4628553 0.72 SCN5A (0.66) SCN5ASCN2A
SCHEMBL4628434 0.72 SCN5A (0.68) SCN5ASCN2ARAB9ANPC1KDM4E

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-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 US claimed
EP-1918272-A1 Pharmaceutically active compounds and methods of use Wyeth a Corporation of the State of Delaware (US) 2008-05-07 EP disclosed
US-20060270741-A1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-11-30 US disclosed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 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-20060270741-A1 Pharmaceutically active compounds and methods of use GBA1, CTSA, GAA SCN5A 1196/4885SCN2A 1613/4885RAB9A 617/4885

“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.