SCHEMBL14909257

SCHEMBL14909257

COc1ncc(N(C(=O)O)C(C)(C)C)cc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 8/20 0.35
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
HDAC4 P56524 3/20 0.33
FFAR1 O14842 1/20 0.32
SLC13A5 Q86YT5 2/20 0.32
SLC13A2 Q13183 1/20 0.32
SLC13A3 Q8WWT9 1/20 0.32
PIK3R1 P27986 2/20 0.31
MTOR P42345 2/20 0.31
DGAT1 O75907 1/20 0.31
HDAC1 Q13547 3/20 0.31
PIK3C3 Q8NEB9 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
HDAC2 Q92769 1/20 0.31

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
SCHEMBL14909691 0.86 SLC13A5 (0.34) SLC13A5DGAT1
SCHEMBL14910048 0.85 KDM4E (0.37) DGAT1
SCHEMBL17633223 0.77 USP2 (0.33)
SCHEMBL14910274 0.77 GRM5 (0.34)
SCHEMBL14910857 0.75 HDAC4 (0.35) HDAC4
SCHEMBL5137736 0.75 PIK3CA (0.34) PIK3CAPDE4APDE4BPDE4CPDE4D
SCHEMBL16554398 0.74 PIK3CA (0.36) PIK3CAPTGES2HDAC4PIK3R1MTOR
SCHEMBL2767334 0.72 LTC4S (0.35)
SCHEMBL1427632 0.72 OXTR (0.49)
SCHEMBL14910553 0.71 LMNA (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2589592-B1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM CORP (JP) 2018-08-22 EP 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-8772320-B2 2014-07-08 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 PIK3CA 633/4885PDE4A 1118/4885PDE4B 1256/4885

“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.