SCHEMBL1645337

SCHEMBL1645337

CCNc1cc(F)c([C@@H](C)NC(=O)c2cnc3cc(C(F)(F)F)ccc3c2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 5/20 0.42
MAOB P27338 1/20 0.42
HPGDS O60760 6/20 0.40
BRAF P15056 1/20 0.40
RIPK1 Q13546 7/20 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
SCHEMBL1645409 0.87 PDE2A (0.44) PDE2ARIPK1
SCHEMBL1284842 0.87 PDE2A (0.44) PDE2AMAOBHPGDSBRAFRIPK1
SCHEMBL1644227 0.87 PDE2A (0.40) PDE2AHPGDSRIPK1
SCHEMBL1644385 0.86 MAOB (0.43) PDE2AMAOBHPGDSBRAF
SCHEMBL14378401 0.85 PDE2A (0.45) PDE2AMAOBHPGDSBRAFRIPK1
SCHEMBL1643052 0.85 HPGDS (0.42) PDE2AMAOBHPGDS
SCHEMBL1645066 0.84 PDE2A (0.35) PDE2AHPGDSBRAFRIPK1
SCHEMBL1644195 0.84 PDE2A (0.48) PDE2ARIPK1
SCHEMBL1645206 0.83 HPGDS (0.43) PDE2AMAOBHPGDS
SCHEMBL1645220 0.82 PDE2A (0.36) PDE2ABRAFRIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 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-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME TRPV1, TRPA1, TRPV2 PDE2A 1116/4885MAOB 3327/4885HPGDS 427/4885

“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.