SCHEMBL16169014

SCHEMBL16169014

CC(C)[C@H](N[S@+]([O-])C(C)(C)C)c1cc(F)cc(F)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.32
CXCR2 P25025 1/20 0.32

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
SCHEMBL18854455 1.00 SLC6A3 (0.32) SLC6A3CXCR2
SCHEMBL17028217 1.00 SLC6A3 (0.32) SLC6A3CXCR2
SCHEMBL16168996 0.84 HDAC4 (0.36) CXCR2
SCHEMBL19594932 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL18862528 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL16341000 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL18854454 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL17041222 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL28917911 0.83 SLC6A3 (0.33) SLC6A3
SCHEMBL16340999 0.83 SLC6A3 (0.33) SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051310-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2015-06-09 US disclosed
US-20140309225-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2014-10-16 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-20140309225-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, BTK, NOX4 SLC6A3 972/4885CXCR2 236/4885

“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.