SCHEMBL14923672

SCHEMBL14923672

CC(C)(C)OC(=O)Nc1cnc(C2CC2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.47
SYK P43405 1/20 0.43
DGAT1 O75907 2/20 0.43
MAPKAPK2 P49137 3/20 0.41
EGLN2 Q96KS0 2/20 0.39
NAMPT P43490 1/20 0.37
MAP4K4 O95819 1/20 0.37
AR P10275 1/20 0.37
BRAF P15056 1/20 0.37

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
SCHEMBL22803712 0.88 RORC (0.43) RORCSYKDGAT1MAPKAPK2EGLN2
SCHEMBL30412966 0.82 SYK (0.39) RORCSYKDGAT1MAPKAPK2EGLN2
SCHEMBL29813612 0.80 SYK (0.45) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL15081332 0.80 SYK (0.45) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL30004261 0.79 SYK (0.44) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL2015768 0.79 SYK (0.44) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL25898751 0.79 SYK (0.44) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL29509761 0.79 SYK (0.44) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL29178680 0.79 SYK (0.44) RORCSYKMAPKAPK2EGLN2NAMPT
SCHEMBL23147868 0.77 SYK (0.43) RORCSYKMAPKAPK2EGLN2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 EP 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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK RORC 492/4885SYK 1/4885DGAT1 2937/4885

“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.