SCHEMBL4851189

SCHEMBL4851189

CC(Nc1ncc2cc(C(O)c3ccccc3Cl)n(-c3c(F)cccc3F)c2n1)C(C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNF P01375 14/20 0.38
MAPK14 Q16539 3/20 0.38
WEE1 P30291 2/20 0.37
FGFR1 P11362 1/20 0.36
CYP2C19 P33261 1/20 0.34

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
SCHEMBL14158810 0.85 MAPK14 (0.36) MAPK14WEE1
SCHEMBL4848848 0.80 MAPK14 (0.41) TNFMAPK14WEE1FGFR1
SCHEMBL4848856 0.80 MAPK14 (0.41) TNFMAPK14WEE1FGFR1
SCHEMBL4856509 0.79 MAPK14 (0.36) TNFMAPK14WEE1FGFR1
SCHEMBL4856513 0.79 MAPK14 (0.36) TNFMAPK14WEE1FGFR1
SCHEMBL4854187 0.78 AURKA (0.36) MAPK14WEE1FGFR1
SCHEMBL4856042 0.77 MAPK14 (0.37) MAPK14WEE1FGFR1
SCHEMBL14158879 0.75 MAPK14 (0.36) MAPK14WEE1
SCHEMBL4848607 0.73 MAPK14 (0.39) MAPK14
SCHEMBL4848602 0.73 MAPK14 (0.39) MAPK14

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-20080139588-A1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY 2008-06-12 US disclosed
US-7319102-B1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-01-15 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-20080139588-A1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors DPYD, IL1B, IL6 TNF 5/4885MAPK14 2806/4885WEE1 2835/4885

“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.