SCHEMBL13757115

SCHEMBL13757115

OCC1COc2cccnc2N1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.39
LTA4H P09960 4/20 0.36
GAA P10253 1/20 0.34
PDE10A Q9Y233 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL29908494 0.98 RIPK1 (0.39) RIPK1LTA4HGAAPDE10ANISCH
SCHEMBL21187104 0.76 NISCH (0.36) RIPK1LTA4HNISCHHTTMEN1
SCHEMBL20798386 0.76 PDE10A (0.39) RIPK1LTA4HPDE10ANISCHMEN1
SCHEMBL20798385 0.76 PDE10A (0.39) RIPK1LTA4HPDE10ANISCHMEN1
SCHEMBL14421731 0.75 CREBBP (0.39) LTA4HGAA
SCHEMBL3587691 0.74
SCHEMBL19859198 0.74 RIPK1 (0.41) RIPK1LTA4HGAAHPGDTSHR
SCHEMBL5466546 0.73 GAA (0.57) GAANISCHHPGDHTTSMN1; SMN2
SCHEMBL28857808 0.73
SCHEMBL27529870 0.72 RIPK1 (0.35) RIPK1LTA4HNISCHMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576099-B2 Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same RENOVIS, INC. (US) 2009-08-18 US disclosed
US-7576099-B2 Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same RENOVIS, INC. (US) 2009-08-18 US disclosed
US-20080300243-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same RENOVIS, INC. 2008-12-04 US disclosed
US-20080300243-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same RENOVIS, INC. 2008-12-04 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-20080300243-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same TRPV1, TRPA1, TRPV2 RIPK1 1692/4885LTA4H 340/4885GAA 3448/4885

“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.