SCHEMBL8212285

SCHEMBL8212285

CC(C)(C)OC(=O)NCc1ccc(-c2ccccc2OC(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 11/20 0.49
HDAC1 Q13547 1/20 0.47
MME P08473 1/20 0.47
ALDH1A1 P00352 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
GRM2 Q14416 1/20 0.47
NAMPT P43490 1/20 0.47
SCN9A Q15858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
AKT1 P31749 1/20 0.45

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
SCHEMBL2570917 0.83 NPC1 (0.48) HDAC1ALDH1A1LMNAHTTGRM2
SCHEMBL8214975 0.83 HDAC1 (0.50) HDAC1ALDH1A1FFAR4LMNAHTT
SCHEMBL2573830 0.82 RXRA (0.53) HDAC1ALDH1A1LMNAHTTNAMPT
SCHEMBL2566826 0.82 ALDH1A1 (0.49) HDAC1ALDH1A1LMNAHTTGRM2
SCHEMBL2570817 0.81 FAAH (0.52) HDAC1ALDH1A1LMNAHTTGRM2
SCHEMBL2573836 0.81 HDAC1 (0.57) HDAC1GRM2NAMPTL3MBTL1AKT1
SCHEMBL2572733 0.81 FAAH (0.48) HDAC1ALDH1A1LMNAHTTGRM2
SCHEMBL1691047 0.79 HDAC1 (0.67) HDAC1ALDH1A1LMNANAMPTL3MBTL1
SCHEMBL18664525 0.78 GRM2 (0.57) HDAC1LMNAGRM2NAMPTL3MBTL1
SCHEMBL3180689 0.77 L3MBTL1 (0.61) HDAC1NAMPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039467-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2011-10-18 US disclosed
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION 2010-06-10 US disclosed
US-7652020-B2 novel hydantoin derivatives to inhibit matrix metalloproteinases (MMPs), a disintegrin and metalloproteases (ADAMs) and/or tumor necrosis factor alpha converting enzyme (TACE) and in so doing prevent the release of tumor necrosis factor alpha (TNF- alpha ); autoimmune diseases; side effect reduction SCHERING CORPORATION (US) 2010-01-26 US disclosed
US-7638513-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-12-29 US disclosed
US-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases SCHERING CORPORATION 2007-07-19 US disclosed
WO-2007064749-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS AND MICROBIAL DISEASES SCHERING CORPORATION (US) 2007-06-07 WO disclosed
US-20060178366-A1 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION 2006-08-10 US disclosed
WO-2005121130-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2005-12-22 WO 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 (3 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-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases MMP12, ADAMTS1, ADAM33 RORC 1153/4885HDAC1 922/4885MME 129/4885
US-20060178366-A1 Compounds for the treatment of inflammatory disorders MMP12, ADAMTS1, TNF RORC 995/4885HDAC1 702/4885MME 175/4885
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, MMP12, MMP8 RORC 222/4885HDAC1 501/4885MME 181/4885

“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.