SCHEMBL1614647

SCHEMBL1614647

Cc1cc(C(C)(O)C#Cc2ccc3c(c2)N(c2nc(N)ncc2Cl)CC32CCOCC2)no1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 16/20 0.48
MAP4K4 O95819 1/20 0.48
PAK4 O96013 3/20 0.45
PIK3CA P42336 1/20 0.41
PRKD1 Q15139 2/20 0.40

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
SCHEMBL1614086 1.00 MAP3K14 (0.48) MAP3K14MAP4K4PAK4PIK3CAPRKD1
SCHEMBL12714856 1.00 MAP3K14 (0.48) MAP3K14MAP4K4PAK4PIK3CAPRKD1
SCHEMBL1612639 1.00 MAP3K14 (0.48) MAP3K14MAP4K4PAK4PIK3CAPRKD1
SCHEMBL12714854 0.95 MAP3K14 (0.47) MAP3K14MAP4K4PAK4PRKD1
SCHEMBL1613474 0.95 MAP3K14 (0.47) MAP3K14MAP4K4PAK4PRKD1
SCHEMBL12714847 0.95 MAP3K14 (0.47) MAP3K14MAP4K4PAK4PRKD1
SCHEMBL1612136 0.95 MAP3K14 (0.47) MAP3K14MAP4K4PAK4PRKD1
SCHEMBL1612535 0.91 MAP3K14 (0.47) MAP3K14MAP4K4PAK4
SCHEMBL13575151 0.90 MAP3K14 (0.46) MAP3K14MAP4K4PAK4PRKD1
SCHEMBL1612537 0.90 MAP3K14 (0.46) MAP3K14MAP4K4PAK4PRKD1

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-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2011-04-14 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-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS NFKBIA, MAP3K1, MAP3K2 MAP3K14 17/4885MAP4K4 57/4885PAK4 323/4885

“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.