SCHEMBL1285679

SCHEMBL1285679

Cc1cc(C(C)NC(=O)c2ccc3nc(N4CCCCC4)ccc3c2)c(F)cc1NS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.40
HDAC2 Q92769 3/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAP3K5 Q99683 1/20 0.38
RXFP1 Q9HBX9 2/20 0.37
HRH3 Q9Y5N1 1/20 0.36
MCHR1 Q99705 2/20 0.36
KDM4E B2RXH2 1/20 0.36
STK17A Q9UEE5 1/20 0.36
TRPV1 Q8NER1 4/20 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
SCHEMBL1284412 1.00 HDAC3 (0.40) HDAC3HDAC2MAPTTP53SMN1; SMN2
SCHEMBL1285305 0.99 HDAC3 (0.41) HDAC3HDAC2MAPTTP53SMN1; SMN2
SCHEMBL1285304 0.99 HDAC3 (0.41) HDAC3HDAC2MAPTTP53SMN1; SMN2
SCHEMBL1644317 0.93 BRAF (0.41) HDAC3HDAC2MAPTTP53SMN1; SMN2
SCHEMBL1285100 0.92 BRAF (0.42) HDAC3HDAC2MAP3K5KDM4ETRPV1
SCHEMBL1646258 0.92 HDAC3 (0.50) HDAC3HDAC2HRH3KDM4E
SCHEMBL1285568 0.92 PTGER4 (0.39) HDAC3HDAC2TP53HRH3
SCHEMBL1285103 0.92 BRAF (0.42) HDAC3HDAC2MAP3K5KDM4ETRPV1
SCHEMBL1285566 0.92 PTGER4 (0.39) HDAC3HDAC2TP53HRH3
SCHEMBL1284636 0.91 HDAC3 (0.42) HDAC3HDAC2MAPTTP53SMN1; SMN2

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 HDAC3 239/4885HDAC2 453/4885MAPT 3251/4885

“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.