SCHEMBL2422397

SCHEMBL2422397

CCC(C)(O)C1CC=C(C)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRNA7 P36544 1/20 0.31
STAT3 P40763 1/20 0.31
CES2 O00748 1/20 0.31
OSBP P22059 1/20 0.30
OSBP2 Q969R2 1/20 0.30

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
SCHEMBL2424472 0.88 OSBP (0.34) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL12324739 0.81 NR3C1 (0.33) LMNAOSBPOSBP2
SCHEMBL2425327 0.81 LMNA (0.41) LMNACES2
SCHEMBL12324738 0.81 LMNA (0.41) LMNACES2
SCHEMBL2422520 0.74
SCHEMBL31178438 0.69 USP2 (0.38) LMNA
SCHEMBL7546327 0.68
SCHEMBL7550977 0.67 CYP3A4 (0.35) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL7576227 0.66 CYP3A4 (0.34) LMNAMEN1CYP3A4ALOX15MAPK1
SCHEMBL7545401 0.66

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
US-8445732-B2 Organic compounds GIVAUDAN SA (CH) 2013-05-21 US claimed
EP-2252674-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2011-09-07 EP claimed
US-20100331427-A1 Organic Compounds GIVAUDAN SA (CH) 2010-12-30 US claimed
EP-2252674-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-11-24 EP claimed
WO-2009100554-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2009-08-20 WO claimed
US-8445732-B2 Organic compounds GIVAUDAN SA (CH) 2013-05-21 US disclosed
EP-2252674-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2011-09-07 EP disclosed
US-20100331427-A1 Organic Compounds GIVAUDAN SA (CH) 2010-12-30 US disclosed
EP-2252674-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-11-24 EP disclosed
WO-2009100554-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2009-08-20 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-20100331427-A1 Organic Compounds C9, C5, CBR3 LMNA 3019/4885MEN1 2813/4885CYP3A4 33/4885

“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.