SCHEMBL18367153

SCHEMBL18367153

O=COc1ncc2cnn(-c3c(F)cccc3F)c2n1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.34
MAP4K1 Q92918 4/20 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
SCHEMBL18367152 0.75 PIM1 (0.36) MAPK14MAP4K1
SCHEMBL30587478 0.75 PIM1 (0.36) MAPK14MAP4K1
SCHEMBL18376126 0.73 MAPK14 (0.41) MAPK14MAP4K1
SCHEMBL19658858 0.72 MAPK14 (0.42) MAPK14
SCHEMBL18367156 0.72 CYP11B1 (0.39) MAPK14MAP4K1
SCHEMBL30587515 0.72 CYP11B1 (0.39) MAPK14MAP4K1
SCHEMBL18376127 0.71 IRAK4 (0.35) MAPK14MAP4K1
SCHEMBL1888378 0.61 ERN1 (0.40) MAPK14
SCHEMBL29703245 0.61 NPC1 (0.55) MAPK14
SCHEMBL25343285 0.59 SLC2A1 (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-12 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-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF LSS, LPXN, CYP1B1 MAPK14 4704/4885MAP4K1 4741/4885

“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.