SCHEMBL1285401

SCHEMBL1285401

Cc1cc([C@@H](C)NC(=O)c2ccc3nc(N(C)C)ccc3c2)c(F)cc1NS(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.34
PDE2A O00408 5/20 0.34
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
MCHR1 Q99705 3/20 0.33
TRPV1 Q8NER1 2/20 0.33
PPARG P37231 2/20 0.33
CSF1R P07333 1/20 0.32
ROCK2 O75116 1/20 0.32
ROCK1 Q13464 1/20 0.32

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
SCHEMBL1285403 1.00 KMT2A (0.34) KMT2APDE2ABACE1BACE2MCHR1
SCHEMBL1285183 0.91 MAPT (0.37) KMT2ABACE1BACE2MCHR1TRPV1
SCHEMBL1285181 0.91 MAPT (0.37) KMT2ABACE1BACE2MCHR1TRPV1
SCHEMBL1284794 0.87 NPC1 (0.34) KMT2APDE2APPARGROCK2ROCK1
SCHEMBL1643362 0.86 MCHR1 (0.35) KMT2APDE2AMCHR1PPARGROCK2
SCHEMBL1285072 0.86 TRPV1 (0.41) PDE2ATRPV1
SCHEMBL1285056 0.83 TRPV1 (0.34) PDE2ATRPV1
SCHEMBL1284822 0.83 CTSL (0.34) PDE2APPARGROCK2ROCK1
SCHEMBL1285305 0.83 HDAC3 (0.41) MCHR1
SCHEMBL1285304 0.83 HDAC3 (0.41) MCHR1

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 4 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 claimed
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
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 KMT2A 4280/4885PDE2A 1116/4885BACE1 1887/4885

“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.