SCHEMBL4629449

SCHEMBL4629449

NC(=NCCSCc1ccccc1)NC(=O)c1cccc2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 11/20 0.69
SCN2A Q99250 11/20 0.69
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
DRD4 P21917 2/20 0.42
MMP3 P08254 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
NR1H4 Q96RI1 1/20 0.41
POLB P06746 1/20 0.41
PLK1 P53350 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL4628731 0.84 SCN5A (0.84) SCN5ASCN2AKDM4EHPGDL3MBTL1
SCHEMBL4627550 0.82 SCN2A (0.84) SCN5ASCN2AKDM4EL3MBTL1
SCHEMBL4629468 0.82 SCN2A (0.72) SCN5ASCN2AKDM4EHPGDL3MBTL1
SCHEMBL4629273 0.81 SCN5A (1.00) SCN5ASCN2A
SCHEMBL4629442 0.78 LMNA (0.54) SCN5ASCN2AKDM4EHPGDDRD4
SCHEMBL4628993 0.77 SCN2A (0.79) SCN5ASCN2AHPGDL3MBTL1ALDH1A1
SCHEMBL4628364 0.77 SCN2A (1.00) SCN5ASCN2AALDH1A1
SCHEMBL4628434 0.76 SCN5A (0.68) SCN5ASCN2AKDM4EHPGDPOLB
SCHEMBL7110564 0.75 SCN5A (0.62) SCN5ASCN2AKDM4EHPGDL3MBTL1
SCHEMBL4629230 0.74 SCN5A (0.68) SCN5ASCN2AMMP3HDAC8PLK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1613/4885KDM4E 3300/4885

“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.