SCHEMBL3210704

SCHEMBL3210704

COC(=O)C12CCCC(NC(=O)OC(C)(C)C)(C1)C2

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD11B1 P28845 1/20 0.34
BTK Q06187 1/20 0.33
PPIA P62937 2/20 0.32
DPP8 Q6V1X1 2/20 0.32
DPP9 Q86TI2 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
CTSL P07711 1/20 0.30
DGAT1 O75907 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL16244146 0.91 MEN1 (0.34) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL3213624 0.86 BTK (0.37) MEN1MAPK1KMT2ABTKDPP8
SCHEMBL16118624 0.85 MEN1 (0.40) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL20940177 0.85 MEN1 (0.35) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL1536746 0.84 MEN1 (0.37) MEN1MAPK1KMT2AHSD11B1BTK
SCHEMBL20940025 0.82 MEN1 (0.32) MEN1MAPK1KMT2ABTKPPIA
SCHEMBL1933747 0.81 MEN1 (0.39) MEN1MAPK1KMT2AHSD11B1PPIA
SCHEMBL18216705 0.81 BTK (0.35) MEN1MAPK1KMT2ABTKDPP8
SCHEMBL5804382 0.78 MEN1 (0.51) MEN1MAPK1KMT2AHSD11B1DPP8
SCHEMBL19747528 0.76 KMT2A (0.38) MEN1MAPK1KMT2ABTKDPP8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029615-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2010-02-04 US disclosed
EP-2121626-A1 BENZIMIDAZOLE DERIVATIVES Pfizer Products Inc. (US) 2009-11-25 EP disclosed
WO-2008075196-A1 BENZIMIDAZOLE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-06-26 WO 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-20100029615-A1 BENZIMIDAZOLE DERIVATIVES ACIN1, HAT1, CCNE1 MEN1 2892/4885MAPK1 3992/4885KMT2A 1782/4885

“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.