SCHEMBL2102976

SCHEMBL2102976

CCCCCCC(CC)CC1OCCO1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
ALDH1A1 P00352 5/20 0.41
EPHX1 P07099 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
CA2 P00918 1/20 0.34

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
SCHEMBL2100157 1.00 LMNA (0.45) LMNAALDH1A1EPHX1TDP1PRSS1
SCHEMBL2101356 0.98 ALDH1A1 (0.42) LMNAALDH1A1EPHX1TDP1PRSS1
SCHEMBL2101964 0.92 ALDH1A1 (0.48) LMNAALDH1A1TDP1CYP3A4TSHR
SCHEMBL4307129 0.92 LMNA (0.48) LMNAALDH1A1EPHX1
SCHEMBL4304766 0.92 LMNA (0.48) LMNAALDH1A1EPHX1
SCHEMBL4302933 0.92 LMNA (0.48) LMNAALDH1A1EPHX1
SCHEMBL4303893 0.92 LMNA (0.48) LMNAALDH1A1EPHX1
SCHEMBL4296250 0.92 LMNA (0.48) LMNAALDH1A1EPHX1
SCHEMBL2101976 0.91 LMNA (0.47) LMNAALDH1A1EPHX1CA2
SCHEMBL2103032 0.91 LMNA (0.47) LMNAALDH1A1EPHX1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270288-A1 ALKYL ACETAL COMPOUND, PROCESS FOR PRODUCING THE SAME, AND LUBRICATING OIL COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2009-10-29 US claimed
US-8158564-B2 Alkyl acetal compound, process for producing the same, and lubricating oil composition IDEMITSU KOSAN CO., LTD. (JP) 2012-04-17 US disclosed
US-7838692-B2 Alkyl acetal compound, process for producing the same, and lubricating oil composition IDEMITSU KOSAN CO., LTD. (JP) 2010-11-23 US disclosed
US-20090270288-A1 ALKYL ACETAL COMPOUND, PROCESS FOR PRODUCING THE SAME, AND LUBRICATING OIL COMPOSITION IDEMITSU KOSAN CO., LTD. (JP) 2009-10-29 US disclosed
US-20080234152-A1 Alkyl Acetal Compound, Process for Producing the Same, and Lubricating Oil Composition IDEMITSU KOSAN CO., LTD. (JP) 2008-09-25 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-20080234152-A1 Alkyl Acetal Compound, Process for Producing the Same, and Lubricating Oil Composition AR, F12, GK LMNA 3935/4885ALDH1A1 125/4885EPHX1 1815/4885

“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.