SCHEMBL14928494

SCHEMBL14928494

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

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.38
HTR1A P08908 1/20 0.35
TSHR P16473 1/20 0.35
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL14908682 0.89 SYK (0.32) SYKHTR1ATSHRTLR8TLR7
SCHEMBL14931124 0.88 TSHR (0.33) SYKHTR1ATSHR
SCHEMBL14928590 0.86 SYK (0.41) SYK
SCHEMBL14928596 0.85 SYK (0.38) SYK
SCHEMBL14928586 0.85 SYK (0.38) SYK
SCHEMBL14929959 0.83 SYK (0.36) SYK
SCHEMBL14917536 0.81 SYK (0.34) SYKTLR8TLR7ALDH1A1HPGD
SCHEMBL14910576 0.80 SYK (0.40) SYK
SCHEMBL14910054 0.80 SYK (0.38) SYK
SCHEMBL16165052 0.80 SYK (0.38) 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 3 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-8809371-B2 2014-08-19 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US 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 1/4885HTR1A 2691/4885TSHR 1886/4885

“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.