Sugi Predict

Sugi Predict / Compounds / SCHEMBL7666147

SCHEMBL7666147

SCHEMBL7666147

C[C@@H]1CC[C@@H](C(C)(C)c2ccccc2)[C@@H](OC(=O)C2C(c3ccccc3)OC(=O)N2C(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31

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
SCHEMBL7667576 1.00 CA1 (0.31) CA1CA2
SCHEMBL7694924 0.89 CA1 (0.35) CA1CA2
SCHEMBL7668489 0.89 CA1 (0.35) CA1CA2
SCHEMBL7672028 0.85 FKBP1A (0.30) —
SCHEMBL7688435 0.85 FKBP1A (0.30) —
SCHEMBL7668412 0.84 ALDH1A1 (0.45) CA1CA2
SCHEMBL7665883 0.83 HSD11B1 (0.34) —
SCHEMBL7674283 0.82 ALDH1A1 (0.37) —
SCHEMBL7672128 0.77 ALDH1A1 (0.45) CA1CA2
SCHEMBL7672505 0.77 ALDH1A1 (0.45) CA1CA2

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-6414160-B1 REACTING 5-ALKOXY-2(3H)OXAZOLONE COMPOUND WITH ALDEHYDE COMPOUND IN PRESENCE OF LEWIS ACID CATALYST UBE INDUSTRIES, LTD. (JP) 2002-07-02 — — US disclosed
EP-1000937-A1 PROCESS FOR PRODUCING 4-ALKOXYCARBONYL-2-OXAZOLIDINONE COMPOUNDS UBE INDUSTRIES LIMITED (JP) 2000-05-17 — — EP disclosed