SCHEMBL2104299

SCHEMBL2104299

CCCCC(CCC)CC1OCCO1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 2/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
CA2 P00918 2/20 0.32
EPHX1 P07099 1/20 0.31
ATM Q13315 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
SCHEMBL2104204 0.96 ALDH1A1 (0.41) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL2103030 0.94 LMNA (0.42) ALDH1A1LMNAEPHX1
SCHEMBL2103094 0.92 LMNA (0.45) ALDH1A1LMNAEPHX1
SCHEMBL2100104 0.92 LMNA (0.45) ALDH1A1LMNAEPHX1
SCHEMBL2101832 0.92 LMNA (0.43) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL2101976 0.90 LMNA (0.47) ALDH1A1LMNACA2EPHX1
SCHEMBL2103032 0.90 LMNA (0.47) ALDH1A1LMNACA2EPHX1
SCHEMBL4302933 0.88 LMNA (0.48) ALDH1A1LMNAEPHX1
SCHEMBL4303893 0.88 LMNA (0.48) ALDH1A1LMNAEPHX1
SCHEMBL4296250 0.88 LMNA (0.48) ALDH1A1LMNAEPHX1

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 ALDH1A1 125/4885TDP1 2584/4885LMNA 3935/4885

“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.