SCHEMBL1644322

SCHEMBL1644322

Cc1cc([C@@H](C)NC(=O)c2cnc3cc(-n4cccn4)ccc3c2)c(F)cc1NS(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
BTK Q06187 2/20 0.37
HPGDS O60760 3/20 0.37
BMX P51813 1/20 0.37
KAT6A Q92794 10/20 0.36
TNIK Q9UKE5 2/20 0.35
FGFR1 P11362 1/20 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
SCHEMBL1644142 0.91 CNR1 (0.37) CNR1KAT6ATNIK
SCHEMBL1285554 0.90 CNR1 (0.41) CNR1KAT6ATNIK
SCHEMBL1284842 0.81 PDE2A (0.44) HPGDS
SCHEMBL14378320 0.79 KDM1A (0.38) CNR1KAT6A
SCHEMBL1285023 0.77 PDE2A (0.40) HPGDS
SCHEMBL1285664 0.77 PDE2A (0.40) HPGDS
SCHEMBL1285349 0.77 TRPV1 (0.36) CNR1
SCHEMBL1644450 0.76 S1PR3 (0.32) CNR1HPGDS
SCHEMBL1285594 0.75 ABL1 (0.38) HPGDS
SCHEMBL1285216 0.75 ABL1 (0.38) HPGDS

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-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
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 CNR1 139/4885BTK 3777/4885HPGDS 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.