SCHEMBL3140263

SCHEMBL3140263

CC(C)C1=CCC(C)(CO)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
EPHX1 P07099 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
SCHEMBL14086110 0.75
SCHEMBL1245680 0.75
SCHEMBL18751499 0.74 PTPN1 (0.31)
SCHEMBL13185499 0.72 EPHX1 (0.31) EPHX1
SCHEMBL27459347 0.68 PTPN1 (0.31)
SCHEMBL8255478 0.67
SCHEMBL31116010 0.66 P2RX7 (0.49) MAPK1EPHX1
SCHEMBL31290424 0.65 HSD17B10 (0.32) ALDH1A1LMNAALOX15
SCHEMBL17125200 0.64 CYP2D6 (0.39) ALDH1A1LMNA
SCHEMBL10254908 0.64 POLB (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2036876-B1 ALCOHOL COMPOUNDS KAO CORP (JP) 2012-08-08 EP disclosed
US-7642385-B2 Perfumes; scent of lily of the valley; 4-isopropyl-1-methyl-1-hydroxymethylcyclohexane, where there is unsaturation either at the isopropyl group, or in the cyclohexane ring e.g. 4-isopropenyl-1-methyl-1-hydroxymethylcyclohexane; low cost starting material; no woody scent limiting its applications KAO CORPORATION (JP) 2010-01-05 US disclosed
US-20090182177-A1 ALCOHOL COMPOUNDS KAO CORPORATION (JP) 2009-07-16 US disclosed
EP-2036876-A1 ALCOHOL COMPOUNDS Kao Corporation (JP) 2009-03-18 EP 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-20090182177-A1 ALCOHOL COMPOUNDS ADH1A, ADH1C, ADH5 ALDH1A1 6/4885LMNA 1644/4885ALOX15 1308/4885

“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.