SCHEMBL4933523

SCHEMBL4933523

CN(C)C(=O)C(Cc1cscn1)CN1C2CCC1CC1(C2)OCc2ccc(F)cc21

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 11/20 0.73
MCHR1 Q99705 4/20 0.34
CAPN1 P07384 3/20 0.30
NPY5R Q15761 1/20 0.30
OPRD1 P41143 1/20 0.30

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
Citric Acid SCHEMBL4943418 0.93 OPRL1 (0.64) OPRL1MCHR1
SCHEMBL4695388 0.91 OPRL1 (0.59) OPRL1MCHR1CAPN1
SCHEMBL4936147 0.89 OPRL1 (0.57) OPRL1MCHR1NPY5ROPRD1
SCHEMBL4900181 0.88 OPRL1 (0.56) OPRL1MCHR1CAPN1
Trifluoroacetic Acid SCHEMBL4900055 0.87 OPRL1 (0.56) OPRL1CAPN1
SCHEMBL4900056 0.86 OPRL1 (0.54) OPRL1CAPN1
SCHEMBL4977890 0.84 OPRL1 (1.00) OPRL1MCHR1
SCHEMBL14430128 0.84 OPRL1 (0.75) OPRL1MCHR1CAPN1NPY5ROPRD1
Citric Acid SCHEMBL4932703 0.83 OPRL1 (0.51) OPRL1MCHR1NPY5ROPRD1
SCHEMBL4888999 0.80 OPRL1 (0.46) OPRL1CAPN1OPRD1

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
US-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists PFIZER INC. 2008-08-21 US disclosed
US-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists PFIZER INC. 2008-08-21 US disclosed
US-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists PFIZER INC. 2008-08-21 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-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists OPRL1, OPRD1, OGFRL1 OPRL1 1/4885MCHR1 336/4885CAPN1 861/4885

“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.