SCHEMBL21362941

SCHEMBL21362941

CCC(C)c1ncnn2cncc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.33

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
SCHEMBL4569224 0.83 MAP4K4 (0.39) MAP4K4
SCHEMBL19185470 0.75 NR1I2 (0.31)
SCHEMBL12462959 0.73 TGFBR1 (0.32) MAP4K4
SCHEMBL24983626 0.71 SRC (0.40)
SCHEMBL22607382 0.69 CDK4 (0.36) MAP4K4
SCHEMBL24983717 0.68 LMNA (0.32)
SCHEMBL400091 0.66 MAP4K4 (0.55) MAP4K4
SCHEMBL179556 0.66 MAP4K4 (0.34) MAP4K4
SCHEMBL179557 0.66 MAP4K4 (0.34) MAP4K4
SCHEMBL25468796 0.66 MAP4K4 (0.32) MAP4K4

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-20190282703-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE (ENPP) CONJUGATES AND USES THEREOF ABBVIE INC. 2019-09-19 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-20190282703-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE (ENPP) CONJUGATES AND USES THEREOF ENPP1, ENPP3, ENPEP MAP4K4 2955/4885

“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.