SCHEMBL3221848

SCHEMBL3221848

O=C1C=C/C(=C/c2cccc(C(F)(F)F)c2)O1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 2/20 0.48
TTR P02766 1/20 0.48
PIM1 P11309 1/20 0.48
PIM2 Q9P1W9 1/20 0.48
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ATM Q13315 1/20 0.44
FBP1 P09467 1/20 0.43
NFE2L2 Q16236 1/20 0.42
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
P4HB P07237 1/20 0.39
LMNA P02545 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RECQL P46063 1/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL3221855 1.00 CISD1 (0.48) CISD1TTRPIM1PIM2MEN1
SCHEMBL3221863 1.00 CISD1 (0.48) CISD1TTRPIM1PIM2MEN1
SCHEMBL3224593 0.81 CYP1A2 (0.46) PIM1PIM2MEN1KMT2AATM
SCHEMBL3224583 0.81 CYP1A2 (0.46) PIM1PIM2MEN1KMT2AATM
SCHEMBL3224600 0.81 CYP1A2 (0.46) PIM1PIM2MEN1KMT2AATM
SCHEMBL9764617 0.75 MEN1 (0.51) MEN1KMT2AATMLMNAMAPT
SCHEMBL9764615 0.75 MEN1 (0.51) MEN1KMT2AATMLMNAMAPT
SCHEMBL30275425 0.72 KDM4E (0.61) CISD1TTRPIM1PIM2MEN1
SCHEMBL30275426 0.72 KDM4E (0.61) CISD1TTRPIM1PIM2MEN1
SCHEMBL3213362 0.71 CISD1 (0.43) CISD1TTRPIM1PIM2MEN1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101646664-B Furanone compounds BIOSIGNAL LTD 2013-12-04 CN disclosed
US-8586618-B2 Furanone compounds and lactam analogues thereof BIOSIGNAL LIMITED (AU) 2013-11-19 US disclosed
US-8586618-B2 Furanone compounds and lactam analogues thereof BIOSIGNAL LIMITED (AU) 2013-11-19 US disclosed
US-20100035948-A1 Furanone compounds and lactam analogues thereof UNILEVER PLC (GB) 2010-02-11 US disclosed
US-20100035948-A1 Furanone compounds and lactam analogues thereof UNILEVER PLC (GB) 2010-02-11 US disclosed
US-20100035948-A1 Furanone compounds and lactam analogues thereof UNILEVER PLC (GB) 2010-02-11 US disclosed
WO-2008040097-A1 FURANONE COMPOUNDS AND LACTAM ANALOGUES THEREOF BIOSIGNAL LIMITED (AU) 2008-04-10 WO disclosed
WO-2008040097-A1 FURANONE COMPOUNDS AND LACTAM ANALOGUES THEREOF BIOSIGNAL LIMITED (AU) 2008-04-10 WO 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-20100035948-A1 Furanone compounds and lactam analogues thereof FDPS, CYP2C19, MRPL21 CISD1 1248/4885TTR 4438/4885PIM1 2252/4885

“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.