SCHEMBL1139941

SCHEMBL1139941

CCOC(=O)[C@@H]1CC(O[Si](C)(C)C(C)(C)C)C[C@H]1COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
TSHR P16473 1/20 0.36
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA9 Q16790 4/20 0.35
CA12 O43570 3/20 0.35
PKM P14618 1/20 0.35
MDM2 Q00987 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL6412480 0.85 CA1 (0.45) MAPTTSHRCA1CA2CA9
SCHEMBL27057179 0.85 CA1 (0.45) MAPTTSHRCA1CA2CA9
SCHEMBL1139923 0.82 CA1 (0.36) CA1CA2CA9CA12
SCHEMBL1139618 0.82 MEN1 (0.36) MAPTTSHRCA1CA2CA9
SCHEMBL1140016 0.81 CA1 (0.39) MAPTTSHRCA1CA2CA9
SCHEMBL24242829 0.80 CA1 (0.35) MAPTCA1CA2CA9CA12
SCHEMBL1934037 0.80 CA1 (0.35) MAPTCA1CA2CA9CA12
SCHEMBL12855832 0.80 CA1 (0.35) MAPTCA1CA2CA9CA12
SCHEMBL12855792 0.80 CA1 (0.35) MAPTCA1CA2CA9CA12
SCHEMBL1139917 0.80 CA1 (0.39) MAPTTSHRCA1CA2CA9

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
EP-2440521-B1 NOVEL CYCLOPENTANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-04-30 EP disclosed
US-7893099-B2 Cyclopentane derivatives HOFFMAN-LA ROCHE INC. (US) 2011-02-22 US disclosed
US-20100317647-A1 NOVEL CYCLOPENTANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 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-20100317647-A1 NOVEL CYCLOPENTANE DERIVATIVES TBXA2R, ADORA1, CNR1 MAPT 2617/4885TSHR 2108/4885CA1 2621/4885

“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.