SCHEMBL5635010

SCHEMBL5635010

CCNC(=O)N(C(=O)CC(c1ccccc1)c1ccccc1)C(C1CCNC1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.39
CACNA2D1 P54289 2/20 0.39
CACNA1B Q00975 2/20 0.39
CACNB1 Q02641 2/20 0.39
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
SLC6A2 P23975 7/20 0.35
SLC6A4 P31645 7/20 0.35
SLC6A3 Q01959 7/20 0.35
KCNH2 Q12809 1/20 0.35
SMYD3 Q9H7B4 2/20 0.35

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
SCHEMBL5633725 0.82 CACNA2D1 (0.43) OPRD1CACNA2D1CACNA1BCACNB1SLC6A2
SCHEMBL5634353 0.70 SLC6A2 (0.41) OPRD1CACNA2D1CACNA1BCACNB1SLC6A2
SCHEMBL5633714 0.70 LMNA (0.45) OPRD1CACNA2D1CACNA1BCACNB1PKM
SCHEMBL5633551 0.70 SLC6A2 (0.40) OPRD1CACNA2D1CACNA1BCACNB1SLC6A2
SCHEMBL13920771 0.69 SLC6A4 (0.51) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL5633971 0.69 SOS1 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL5633511 0.67 SLC6A2 (0.40) OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL5080882 0.67 SMYD3 (0.50) OPRD1MAPTPKMSMYD3
SCHEMBL5634378 0.65 SLC6A2 (0.46) CACNA2D1CACNA1BCACNB1SLC6A2SLC6A4
SCHEMBL5634881 0.65 SLC6A2 (0.42) OPRD1CACNA2D1CACNA1BCACNB1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244758-B2 N-type calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2007-07-17 US claimed
US-20050014748-A1 N-type calcium channel blockers NEUROMED TECHNOLOGIES INC. 2005-01-20 US claimed

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-20050014748-A1 N-type calcium channel blockers CACNA1B, CACNA1C, CACNA1I OPRD1 212/4885CACNA2D1 30/4885CACNA1B 1/4885

“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.