SCHEMBL13640863

SCHEMBL13640863

CCOC(=O)NC1CCCCC(N2CCC3(CC2)C(=O)N(C)c2ccccc23)C1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 13/20 0.51
OPRM1 P35372 7/20 0.50
OPRK1 P41145 5/20 0.50
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD2 P14416 1/20 0.40
KCNH2 Q12809 1/20 0.40
GRIN2B Q13224 1/20 0.40
OPRD1 P41143 2/20 0.39

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
SCHEMBL20073887 0.83 CHRM1 (0.44) OPRL1OPRM1OPRK1CHRM1DRD2
SCHEMBL13640964 0.83 OPRM1 (0.48) OPRL1OPRM1OPRK1LMNAMAPT
SCHEMBL29709369 0.83 CHRM1 (0.44) OPRL1OPRM1OPRK1CHRM1DRD2
SCHEMBL23799154 0.83 CHRM1 (0.44) OPRL1OPRM1OPRK1CHRM1DRD2
SCHEMBL12084856 0.82 OPRL1 (0.50) OPRL1OPRM1OPRK1LMNAMAPT
SCHEMBL12084491 0.80 OPRL1 (0.49) OPRL1OPRM1OPRK1CHRM1KCNH2
SCHEMBL12084116 0.80 CHRM4 (0.52) OPRL1OPRM1OPRK1LMNACHRM1
SCHEMBL13643940 0.79 OPRL1 (0.51) OPRL1OPRM1OPRK1LMNAMAPT
SCHEMBL13640768 0.79 NOTUM (0.50) OPRL1OPRM1LMNAMAPTDRD2
SCHEMBL13640829 0.79 SIGMAR1 (0.49) OPRL1OPRM1LMNAMAPTDRD2

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-8497295-B2 Spiroindoline modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-30 US disclosed
US-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-08 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-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors CHRM3, CHRM2, CHRM5 OPRL1 108/4885OPRM1 177/4885OPRK1 159/4885

“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.