SCHEMBL4628694

SCHEMBL4628694

NC(=Nc1ccc(OCc2ccccc2)cc1)NC(=O)c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 4/20 0.84
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
PARP10 Q53GL7 1/20 0.56
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
NOS3 P29474 2/20 0.53
NOS1 P29475 2/20 0.53
NOS2 P35228 2/20 0.53
NR4A1 P22736 1/20 0.51
NR4A2 P43354 1/20 0.51
NR4A3 Q92570 1/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SCN5A Q14524 3/20 0.50
NR1H4 Q96RI1 1/20 0.50
HDAC3 O15379 1/20 0.50

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
SCHEMBL4629225 0.92 SCN2A (0.80) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628674 0.92 SCN2A (0.83) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628980 0.92 SCN2A (1.00) SCN2APARP10ALDH1A1MAPTNOS3
SCHEMBL4627476 0.89 SCN2A (0.69) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628715 0.86 SCN2A (0.72) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628743 0.86 SCN2A (0.67) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628948 0.85 SCN2A (0.67) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4627497 0.84 SCN2A (0.66) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628807 0.84 SCN2A (0.66) SCN2ANPC1RAB9ASMN1; SMN2PARP10
SCHEMBL4628996 0.83 SCN2A (0.65) SCN2ANPC1RAB9APARP10ALDH1A1

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 SCN2A 1613/4885NPC1 140/4885RAB9A 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.