SCHEMBL4629433

SCHEMBL4629433

NC(=Nc1ccc(OCc2ccccc2)cc1)NC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 1/20 0.57
EPHX2 P34913 9/20 0.56
FAAH O00519 1/20 0.53
CNR2 P34972 1/20 0.53
ADAM17 P78536 3/20 0.49
HPGD P15428 1/20 0.47
NOS3 P29474 1/20 0.46
NOS1 P29475 1/20 0.46
NOS2 P35228 1/20 0.46

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
SCHEMBL4628743 0.78 SCN2A (0.67) SCN2ANOS3NOS1NOS2
SCHEMBL4629426 0.77 EPHX2 (0.69) EPHX2FAAHCNR2
SCHEMBL4628694 0.77 SCN2A (0.84) SCN2ANOS3NOS1NOS2
SCHEMBL4628704 0.74 MEN1 (0.49) EPHX2
SCHEMBL4629447 0.74 SCN5A (0.52) SCN2A
SCHEMBL4628948 0.73 SCN2A (0.67) SCN2AHPGDNOS3NOS1NOS2
SCHEMBL4629225 0.73 SCN2A (0.80) SCN2A
SCHEMBL4628674 0.73 SCN2A (0.83) SCN2ANOS3NOS1NOS2
SCHEMBL4628980 0.73 SCN2A (1.00) SCN2ANOS3NOS1NOS2
SCHEMBL4628807 0.73 SCN2A (0.66) SCN2ANOS3NOS1NOS2

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 1613/4885EPHX2 1809/4885FAAH 115/4885

“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.