SCHEMBL4628518

SCHEMBL4628518

NC(=NCc1ccc(Cl)cc1)NC(=O)c1cccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 5/20 0.60
SCN5A Q14524 4/20 0.60
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 2/20 0.53
HSP90AA1 P07900 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MALT1 Q9UDY8 3/20 0.49
KDM4E B2RXH2 2/20 0.49
GLA P06280 2/20 0.49
HSD17B10 Q99714 2/20 0.49
NPC1 O15118 2/20 0.49
DRD4 P21917 1/20 0.49
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
CYP2D6 P10635 1/20 0.49
NFKB1 P19838 1/20 0.49
SCNN1A P37088 1/20 0.49

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
SCHEMBL4629468 0.90 SCN2A (0.72) SCN2ASCN5AALDH1A1HPGDMAPT
SCHEMBL4628731 0.78 SCN5A (0.84) SCN2ASCN5AHPGDKDM4EDRD4
SCHEMBL4627554 0.77 SCN2A (0.75) SCN2ASCN5AALDH1A1HPGDMEN1
SCHEMBL4628512 0.76 HDAC2 (0.55) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7110741 0.76 SCN2A (0.59) SCN2ASCN5AALDH1A1HPGDMEN1
SCHEMBL4629273 0.75 SCN5A (1.00) SCN2ASCN5ASCNN1A
SCHEMBL7111661 0.73 SCN2A (0.54) SCN2ASCN5AALDH1A1HPGDMEN1
SCHEMBL5427464 0.73 SCN2A (0.56) SCN2ASCN5AALDH1A1HPGDMEN1
Hydrochloric Acid SCHEMBL7110825 0.73 SCN2A (0.56) SCN2ASCN5AALDH1A1HPGDMEN1
SCHEMBL4629449 0.73 SCN5A (0.69) SCN2ASCN5AALDH1A1HPGDKDM4E

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-A4 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE INC (US) 2005-02-02 EP claimed
EP-1032556-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 2000-09-06 EP claimed
WO-1999020599-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-04-29 WO 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 SCN2A 1613/4885SCN5A 1196/4885ALDH1A1 858/4885

“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.