SCHEMBL2794552

SCHEMBL2794552

Cc1cc(C(=O)O)ncc1C(c1c(F)ccc(F)c1F)S(=O)(=O)CCC(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPC P11150 5/20 0.34
BRAF P15056 1/20 0.33
ASPH Q12797 2/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM8 Q8N371 1/20 0.33
LIPG Q9Y5X9 3/20 0.32
KMO O15229 2/20 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
SCHEMBL2795101 0.91 LIPC (0.35) LIPCBRAFLIPG
SCHEMBL2797696 0.89 LIPC (0.35) LIPCBRAFLIPG
SCHEMBL2798695 0.88 LIPC (0.37) LIPCBRAFLIPG
SCHEMBL2797457 0.87 METAP2 (0.38) LIPCBRAFLIPG
SCHEMBL2797455 0.87 LIPC (0.33) LIPCBRAFLIPG
SCHEMBL2798442 0.85 NR3C1 (0.32) LIPC
SCHEMBL13262441 0.84 P4HTM (0.36) LIPCBRAFKDM4ELIPG
SCHEMBL2799426 0.84 NR3C1 (0.32) LIPC
SCHEMBL2798459 0.83 KMT2A (0.32) LIPC
SCHEMBL2794574 0.83 NR3C1 (0.30) LIPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2204365-A1 ALKYLSULFONE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-07-07 EP disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 US disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 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-20100168136-A1 ALKYLSULFONE DERIVATIVES BACE1, APP, AMY1A LIPC 1380/4885BRAF 1162/4885ASPH 421/4885

“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.