SCHEMBL3053446

SCHEMBL3053446

CC(C)=CCC[C@@](C)(OC=O)[C@H]1CC=C(C)CC1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.74
LMNA P02545 3/20 0.74
CYP3A4 P08684 2/20 0.74
STAT3 P40763 2/20 0.65
MEN1 O00255 1/20 0.65
MAPK1 P28482 1/20 0.65
KMT2A Q03164 1/20 0.65
CHRNA7 P36544 1/20 0.65
PTPN1 P18031 2/20 0.61
HIF1A Q16665 4/20 0.33
EPAS1 Q99814 4/20 0.33
CES2 O00748 2/20 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
SCHEMBL13136691 1.00 ALOX15 (0.74) ALOX15LMNACYP3A4STAT3MEN1
Bisabolol Acetate SCHEMBL4279285 0.85 LMNA (1.00) ALOX15LMNACYP3A4STAT3MEN1
SCHEMBL13177710 0.84 ALOX15 (0.72) ALOX15LMNACYP3A4STAT3MEN1
SCHEMBL8510625 0.82 LMNA (0.70) ALOX15LMNACYP3A4STAT3MEN1
Levomenol SCHEMBL14515491 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1
Levomenol SCHEMBL1245143 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1
Bisabolol SCHEMBL13220166 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1
Levomenol SCHEMBL20838984 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1
Levomenol SCHEMBL4259122 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1
Levomenol SCHEMBL2728600 0.79 ALOX15 (1.00) ALOX15LMNACYP3A4STAT3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222606-A1 METHOD FOR PRODUCING BISABOLOL WHICH IS FARNESOL FREE OR IS LOW IN FARNESOL BASF SE (DE) 2010-09-02 US claimed
US-20100222606-A1 METHOD FOR PRODUCING BISABOLOL WHICH IS FARNESOL FREE OR IS LOW IN FARNESOL BASF SE (DE) 2010-09-02 US 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-20100222606-A1 METHOD FOR PRODUCING BISABOLOL WHICH IS FARNESOL FREE OR IS LOW IN FARNESOL FHIT, FDPS, FNTA ALOX15 292/4885LMNA 1546/4885CYP3A4 156/4885

“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.