Sugi Predict

Sugi Predict / Compounds / SCHEMBL14752178

SCHEMBL14752178

SCHEMBL14752178

C[C@@H]1[C@@H](O)c2c(cc(-c3cccnc3)oc2=O)O[C@H](C)[C@@H](O)C[C@H]2C(C)(COC(=O)C3CC3)[C@@H](OC(=O)C3CC3)CC[C@]12C

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SOAT2 O75908 11/20 0.60
▸ SOAT1 P35610 10/20 0.60

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
SCHEMBL233526 0.89 SOAT2 (0.60) SOAT2SOAT1
SCHEMBL895914 0.89 SOAT2 (0.60) SOAT2SOAT1
SCHEMBL15455939 0.89 SOAT2 (0.60) SOAT2SOAT1
SCHEMBL10015331 0.84 SOAT2 (0.83) SOAT2SOAT1
SCHEMBL14777068 0.84 SOAT2 (0.75) SOAT2SOAT1
SCHEMBL20960744 0.84 SOAT2 (0.75) SOAT2SOAT1
SCHEMBL727488 0.84 SOAT2 (0.75) SOAT2SOAT1
SCHEMBL22975386 0.84 SOAT2 (0.75) SOAT2SOAT1
SCHEMBL20007537 0.84 SOAT2 (0.75) SOAT2SOAT1
SCHEMBL807168 0.84 SOAT2 (0.75) SOAT2SOAT1

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
WO-2013030262-A1 INSECTICIDAL ACTIVE MIXTURES COMPRISING ARYLQUINAZOLINONE COMPOUNDS BASF SE (DE) 2013-03-07 — — WO disclosed