SCHEMBL13416396

SCHEMBL13416396

CC(C)[C@@H]1Cc2ccccc2CN1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PNMT P11086 8/20 0.67
ADRA2A P08913 2/20 0.62
ADRA2B P18089 2/20 0.62
ADRA2C P18825 2/20 0.62
PRCP P42785 2/20 0.48

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
SCHEMBL31158806 1.00 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL31158866 1.00 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL12741563 1.00 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL13181686 0.85 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL19853263 0.85 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL23280449 0.82 PNMT (0.59) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL20759206 0.81 PNMT (0.54) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL10327325 0.81 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL10326622 0.81 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL21505499 0.81 PNMT (0.49) PNMTADRA2AADRA2BADRA2CPRCP

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-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 US disclosed
US-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 PNMT 322/4885ADRA2A 33/4885ADRA2B 24/4885

“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.