SCHEMBL3941677

SCHEMBL3941677

CC(C)=CCC1CC(C)OC1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
TP53 P04637 1/20 0.47
ATM Q13315 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HTT P42858 3/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
BLM P54132 1/20 0.41
ABCB11 O95342 1/20 0.35
LMNA P02545 1/20 0.35
PTGS1 P23219 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
FNTA P49354 1/20 0.32
PGGT1B P53609 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL577431 0.78 KMT2A (0.42) KMT2ATP53ATMKDM4EHTT
SCHEMBL14883094 0.78 KMT2A (0.42) KMT2ATP53ATMKDM4EHTT
SCHEMBL11447431 0.75
SCHEMBL11447429 0.75
SCHEMBL11447430 0.75
SCHEMBL18077994 0.74 KMT2A (0.56) KMT2ATP53ATMKDM4EHTT
SCHEMBL576074 0.72
SCHEMBL662721 0.72
SCHEMBL13041673 0.72
SCHEMBL662723 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP claimed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US claimed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP claimed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO claimed
JP-8073450-A None JP disclosed
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP disclosed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO disclosed
JP-H0873450-A 2-OR 4-METHYL-2-PRENYL-4-BUTANOLIDE T HASEGAWA CO LTD 1996-03-19 JP 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-20090311403-A1 Method of Using Organic Compounds MGLL, GK, LIPC KMT2A 3062/4885TP53 3964/4885ATM 1882/4885

“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.