SCHEMBL3864809

SCHEMBL3864809

Oc1cccc(Nc2nc(F)ncc2F)c1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 0.76
AURKA O14965 3/20 0.58
MAPK8 P45983 1/20 0.58
AURKB Q96GD4 1/20 0.58
CDK19 Q9BWU1 1/20 0.58

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
R-112 SCHEMBL655935 0.87 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
R-112 SCHEMBL29360016 0.87 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL27631427 0.87 SYK (0.74) SYKAURKAMAPK8AURKBCDK19
R-112 SCHEMBL31294216 0.87 SYK (1.00) SYKAURKAMAPK8AURKBCDK19
SCHEMBL654694 0.85 SYK (0.72) SYKAURKAMAPK8AURKBCDK19
SCHEMBL656495 0.81 SYK (0.87) SYKAURKAMAPK8AURKBCDK19
SCHEMBL657334 0.81 SYK (0.87) SYKAURKAMAPK8AURKBCDK19
SCHEMBL27612598 0.80 SYK (0.85) SYKAURKAMAPK8AURKBCDK19
SCHEMBL12567975 0.80 SYK (0.85) SYKAURKAMAPK8AURKBCDK19
SCHEMBL658886 0.79 SYK (0.74) SYKAURKAMAPK8AURKBCDK19

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-7589200-B2 5-Fluoro-4N-phenyl-4-pyrimidineamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2009-09-15 US disclosed
US-20050209230-A1 2-leaving group-4-(substituted amino)-5-fluoropyrimidines such as 2-chloro-N4-(2-hydroxyphenyl)-5-fluoro-4-pyrimidineamine; chemical intermediates to compounds that inhibit the immunoglobulin (Ig) IgE and/or IgG receptor signaling cascades MIDCAP FINANCIAL TRUST 2005-09-22 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-20050209230-A1 2-leaving group-4-(substituted amino)-5-fluoropyrimidines such as 2-chloro-N4-(2-hydroxyphenyl)-5-fluoro-4-pyrimidineamine; chemical intermediates to compounds that inhibit the immunoglobulin (Ig) IgE and/or IgG receptor signaling cascades FCER2, FCGR1A, FCGR2A SYK 42/4885AURKA 1583/4885MAPK8 1172/4885

“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.