SCHEMBL25977477

SCHEMBL25977477

CCC1COC(CC(=O)OC)CO1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MIF P14174 7/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PRKCA P17252 2/20 0.35
TSHR P16473 3/20 0.34
ALDH1A1 P00352 1/20 0.34
BRD4 O60885 1/20 0.34
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 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
SCHEMBL24454734 1.00 MIF (0.37) MIFHDAC6PRKCATSHRALDH1A1
SCHEMBL3070099 0.90
SCHEMBL28619795 0.90
SCHEMBL24454457 0.85 MIF (0.37) MIFHDAC6PRKCATSHRALDH1A1
SCHEMBL24454692 0.83 MIF (0.36) MIFHDAC6PRKCATSHRALDH1A1
SCHEMBL9724891 0.77 MIF (0.37) MIFHDAC6PRKCATSHRBRD4
SCHEMBL14454532 0.76 MIF (0.36) MIFHDAC6PRKCATSHRBRD4
SCHEMBL8436542 0.76 CHRM2 (0.43) MIFHDAC6TSHRALDH1A1BRD4
SCHEMBL8065510 0.76 CHRM2 (0.43) MIFHDAC6TSHRALDH1A1BRD4
SCHEMBL321971 0.74

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
EP-4227308-A1 TETRAHYDROBENZOFURODIAZEPINONE COMPOUNDS AND PHARMACEUTICAL APPLICATIONS THEREOF Japan Tobacco Inc. (JP) 2023-08-16 EP disclosed