SCHEMBL14908682

SCHEMBL14908682

Cc1cc(Nc2nc(N[C@H](CCCN3C(=O)c4ccccc4C3=O)[C@H](C)N(C(=O)O)C(C)(C)C)c(F)cc2C(N)=O)cnc1C

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.32
TSHR P16473 1/20 0.32
HTR1A P08908 1/20 0.32
MAPK8 P45983 1/20 0.32
PDE4B Q07343 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
DHODH Q02127 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL14928494 0.89 SYK (0.38) SYKTSHRHTR1ATLR8TLR7
SCHEMBL14909045 0.88 SYK (0.37) SYK
SCHEMBL14909048 0.88 SYK (0.37) SYK
SCHEMBL14917536 0.87 SYK (0.34) SYKMAPK8TLR8TLR7DHODH
SCHEMBL14931124 0.85 TSHR (0.33) SYKTSHRHTR1A
SCHEMBL14908915 0.83 SYK (0.32) SYK
SCHEMBL14909214 0.83 SYK (0.32) SYK
SCHEMBL14928590 0.75 SYK (0.41) SYK
SCHEMBL14928586 0.75 SYK (0.38) SYK
SCHEMBL14910576 0.75 SYK (0.40) SYK

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 SYK 1/4885TSHR 1886/4885HTR1A 2691/4885

“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.