SCHEMBL20465740

SCHEMBL20465740

Cc1nc2nc(SC(C)c3ccccc3F)nc(N[C@@H](CO)CC(C)C)c2s1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CX3CR1 P49238 20/20 0.82
CXCR2 P25025 18/20 0.82
ADORA1 P30542 1/20 0.64

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
SCHEMBL31199186 0.90 CX3CR1 (1.00) CX3CR1CXCR2ADORA1
SCHEMBL18312509 0.90 CX3CR1 (1.00) CX3CR1CXCR2ADORA1
SCHEMBL20455391 0.90 CX3CR1 (1.00) CX3CR1CXCR2ADORA1
SCHEMBL215431 0.90 CX3CR1 (1.00) CX3CR1CXCR2ADORA1
SCHEMBL215568 0.90 CX3CR1 (0.80) CX3CR1CXCR2ADORA1
SCHEMBL214279 0.88 CX3CR1 (0.78) CX3CR1CXCR2ADORA1
SCHEMBL20465738 0.87 CX3CR1 (0.66) CX3CR1CXCR2ADORA1
SCHEMBL20465743 0.83 CXCR2 (0.82) CX3CR1CXCR2
SCHEMBL213072 0.82 CXCR2 (0.80) CX3CR1CXCR2ADORA1
SCHEMBL214469 0.80 CXCR2 (0.82) CX3CR1CXCR2ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180222922-A1 RADIOFLUORINATED 7-AMINO-5-THIO-THIAZOLO[4,5-D]PYRIMIDINES FOR IMAGING FRACTALKINE RECEPTOR (CX3CR1) THE JOHNS HOPKINS UNIVERSITY (US) 2018-08-09 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-20180222922-A1 RADIOFLUORINATED 7-AMINO-5-THIO-THIAZOLO[4,5-D]PYRIMIDINES FOR IMAGING FRACTALKINE RECEPTOR (CX3CR1) CX3CR1, CXCR3, CXCR5 CX3CR1 1/4885CXCR2 15/4885ADORA1 441/4885

“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.