SCHEMBL1285252

SCHEMBL1285252

Cc1cc([C@@H](C)NC(=O)c2cnc3cc(C(C)C)ccc3c2)ccc1NS(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 10/20 0.44
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KRAS P01116 1/20 0.37
SOS1 Q07889 1/20 0.37
LMNA P02545 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
PRKACA P17612 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
PRKX P51817 1/20 0.35
PRKCQ Q04759 1/20 0.35
MST1R Q04912 1/20 0.35
ROCK1 Q13464 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
SCHEMBL1285351 0.89 BCAT1 (0.44) HPGDSKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1284733 0.89 TRPV1 (0.42) HPGDS
SCHEMBL1285590 0.88 DDR2 (0.42) HPGDS
SCHEMBL1644034 0.85 HPGDS (0.45) HPGDSHDAC6PRKACAGSK3AGSK3B
SCHEMBL1285047 0.83 HPGDS (0.45) HPGDSKDM4EKRASSOS1LMNA
SCHEMBL1285184 0.83 TRPV1 (0.44)
SCHEMBL14377396 0.83 HPGDS (0.48) HPGDSHDAC6PRKACAGSK3AGSK3B
SCHEMBL1285475 0.82 KDM4E (0.39) HPGDSKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1285171 0.82 PDE2A (0.42) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1285476 0.81 KDM4E (0.48) HPGDSKDM4EALDH1A1HPGDHSD17B10

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 HPGDS 427/4885KDM4E 4075/4885ALDH1A1 1265/4885

“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.