SCHEMBL428916

SCHEMBL428916

NC1(Cc2[nH]c3c(c2C(=O)O)CCc2cnc(-c4ccc(C(F)(F)F)nc4)cc2-3)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 10/20 0.40
PTGES O14684 1/20 0.35
MPL P40238 3/20 0.34
CGAS Q8N884 1/20 0.34
MAP4K4 O95819 1/20 0.34
PIK3CA P42336 1/20 0.34
KCNH2 Q12809 1/20 0.34
MINK1 Q8N4C8 1/20 0.34
PI4KB Q9UBF8 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
SCHEMBL428413 0.88 MAPKAPK2 (0.51) MAPKAPK2MPL
SCHEMBL424661 0.86 MAPKAPK2 (0.40) MAPKAPK2MPL
SCHEMBL432018 0.86 MAPKAPK2 (0.39) MAPKAPK2MPL
SCHEMBL430919 0.85 MAPKAPK2 (0.53) MAPKAPK2MPL
SCHEMBL431329 0.85 MAPKAPK2 (0.50) MAPKAPK2MPL
SCHEMBL431508 0.84 MAPKAPK2 (0.42) MAPKAPK2MPL
SCHEMBL428440 0.84 MPL (0.41) MAPKAPK2MPL
SCHEMBL424935 0.84 MAPKAPK2 (0.38) MAPKAPK2MPL
SCHEMBL428121 0.84 MAPKAPK2 (0.38) MAPKAPK2
SCHEMBL429718 0.84 MAPKAPK2 (0.39) MAPKAPK2

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-20120022030-A1 Tetracyclic Lactame Derivatives NOVARTIS AG 2012-01-26 US disclosed
CN-101687869-A Tetracyclic lactam derivatives as MK2 inhibitors NOVARTIS AG 2010-03-31 CN 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-20120022030-A1 Tetracyclic Lactame Derivatives TNF, RPS6KB2, RPS6KA2 MAPKAPK2 480/4885PTGES 226/4885MPL 132/4885

“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.