SCHEMBL7353255

SCHEMBL7353255

CC(C)(C)OC(=O)OP(C)(=O)OC(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.35
DGAT1 O75907 1/20 0.34
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 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
SCHEMBL7353264 0.83 ELANE (0.34) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL29657305 0.80 CA4 (0.40) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL30114986 0.80 ELANE (0.35) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL9014663 0.78 CYP1A2 (0.30)
SCHEMBL30973572 0.76 ELANE (0.33) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL29121 0.74 DGAT1 (0.46) ELANEDGAT1HDAC6HDAC1HDAC2
SCHEMBL30417060 0.73 HDAC6 (0.32) HDAC6HDAC1HDAC2
SCHEMBL30918746 0.73 FDPS (0.36) ELANEDGAT1
Ammonia Solution, Strong SCHEMBL9998492 0.72 DGAT1 (0.43) ELANEDGAT1HDAC6HDAC1HDAC2
Fluoride SCHEMBL2692246 0.72 DGAT1 (0.43) ELANEDGAT1HDAC6HDAC1HDAC2

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-1994018188-A1 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL[B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS THE UPJOHN COMPANY (US) 1994-08-18 WO disclosed