SCHEMBL14909801

SCHEMBL14909801

NC(=O)c1cc(F)c(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cncc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FER P16591 5/20 0.55
JAK2 O60674 1/20 0.55
ROCK2 O75116 1/20 0.55
MAP4K4 O95819 1/20 0.55
HCK P08631 1/20 0.55
ROS1 P08922 1/20 0.55
PIM1 P11309 1/20 0.55
PRKACA P17612 1/20 0.55
MARK3 P27448 1/20 0.55
LTK P29376 1/20 0.55
FLT3 P36888 1/20 0.55
CSNK1A1 P48729 1/20 0.55
CLK2 P49760 1/20 0.55
MAPK10 P53779 1/20 0.55
MAP2K1 Q02750 1/20 0.55
MAP3K10 Q02779 1/20 0.55
PRKCQ Q04759 1/20 0.55
PTK2 Q05397 1/20 0.55
TYRO3 Q06418 1/20 0.55
STK3 Q13188 1/20 0.55

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
SCHEMBL14909800 1.00 FER (0.55) FERJAK2ROCK2MAP4K4HCK
SCHEMBL14929853 0.91 FER (0.53) FERSYK
SCHEMBL14910724 0.91 FER (0.53) FERSYK
SCHEMBL14910720 0.91 FER (0.53) FERSYK
SCHEMBL14911277 0.90 SYK (0.52) FERSYK
SCHEMBL14909351 0.90 SYK (0.54) FERSYK
SCHEMBL5027878 0.90 SYK (0.54) FERSYK
SCHEMBL14929902 0.90 SYK (0.52) FERSYK
SCHEMBL14910793 0.90 SYK (0.52) FERSYK
SCHEMBL14923955 0.90 SYK (0.52) FERSYK

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 13 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-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-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
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
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 FER 919/4885JAK2 28/4885ROCK2 1485/4885

“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.