SCHEMBL4628769

SCHEMBL4628769

CC(C)Oc1ccc(N=C(N)NC(=O)c2ccccc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 4/20 0.79
SCN5A Q14524 3/20 0.79
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 1/20 0.49
SMO Q99835 3/20 0.48
PARP10 Q53GL7 1/20 0.48
IMPDH2 P12268 1/20 0.46
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 1/20 0.45
ALOX12 P18054 1/20 0.45
KMT2A Q03164 2/20 0.45
GLA P06280 1/20 0.44
MEN1 O00255 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 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
SCHEMBL4628520 0.88 SCN2A (1.00) SCN2ASCN5AALDH1A1PARP10RAB9A
SCHEMBL4629391 0.88 SCN2A (0.81) SCN2ASCN5APARP10RAB9ASMN1; SMN2
SCHEMBL4628747 0.85 SCN2A (0.76) SCN2ASCN5AALDH1A1CYP1A2PARP10
SCHEMBL17590500 0.84 SCN2A (0.71) SCN2ASCN5AALDH1A1PARP10RAB9A
SCHEMBL4628501 0.83 SCN2A (0.73) SCN2ASCN5APARP10SMN1; SMN2LMNA
SCHEMBL4629406 0.82 SCN2A (0.78) SCN2ASCN5AALDH1A1CYP1A2SMO
SCHEMBL4628762 0.82 CNR2 (0.60) SCN2ASCN5ARAB9ANPC1KMT2A
SCHEMBL4627498 0.81 SCN5A (0.66) SCN2ASCN5AALDH1A1SMOALOX12
SCHEMBL4628513 0.81 SCN2A (0.60) SCN2ASCN5AALDH1A1RAB9ASMN1; SMN2
SCHEMBL4628694 0.78 SCN2A (0.84) SCN2ASCN5AALDH1A1PARP10RAB9A

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 1613/4885SCN5A 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.