SCHEMBL4628973

SCHEMBL4628973

NC(=Nc1cccc2ccccc12)NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 5/20 0.77
SMN1; SMN2 Q16637 2/20 0.54
SIGMAR1 Q99720 4/20 0.51
GRIN2D O15399 1/20 0.51
GRIN3B O60391 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
GRIN3A Q8TCU5 1/20 0.51
SCN5A Q14524 4/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
TPH1 P17752 1/20 0.43
F2 P00734 1/20 0.43
PLG P00747 1/20 0.43

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
SCHEMBL4629286 0.87 SCN2A (1.00) SCN2ASMN1; SMN2SIGMAR1GRIN2DGRIN3B
SCHEMBL4628426 0.86 SCN2A (0.68) SCN2ASMN1; SMN2SIGMAR1GRIN2DGRIN3B
SCHEMBL4627507 0.83 SCN2A (0.57) SCN2ASMN1; SMN2SIGMAR1GRIN2DGRIN3B
SCHEMBL4657604 0.79 SCN2A (0.65) SCN2ASMN1; SMN2SIGMAR1GRIN2DGRIN3B
SCHEMBL27689880 0.77 SCN2A (0.67) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL4628701 0.75 SCN2A (0.60) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL4627486 0.75 SCN2A (0.60) SCN2ASMN1; SMN2SIGMAR1GRIN2DGRIN3B
SCHEMBL7427722 0.75 SIGMAR1 (0.64) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
Guanidine SCHEMBL27709676 0.75 SCN2A (0.64) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL4628419 0.71 SMN1; SMN2 (0.51) SCN2ASMN1; SMN2SCN5AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 EP claimed
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
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 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 SCN2A 1613/4885SMN1; SMN2 53/4885SIGMAR1 2799/4885

“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.