SCHEMBL4814593

SCHEMBL4814593

CC(=O)OC1CCCC1(CCc1ccccc1)C(=O)OCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
PKM P14618 1/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ACE P12821 3/20 0.35
ALDH1A1 P00352 2/20 0.35
EP300 Q09472 1/20 0.35
HIF1A Q16665 1/20 0.35
CREBBP Q92793 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL4809671 0.89 CHRNA7 (0.40) LMNAPOLBPKMMAPTKMT2A
SCHEMBL4814688 0.89 LMNA (0.47) LMNAPOLBPKMMAPTKDM4E
SCHEMBL4811693 0.89 KDM4E (0.37) KDM4EKMT2AMEN1ALDH1A1EP300
SCHEMBL4806319 0.88 ALDH1A1 (0.39) LMNAPOLBPKMMAPTKDM4E
SCHEMBL27655524 0.87 ALDH1A1 (0.40) LMNAPOLBPKMMAPTKDM4E
SCHEMBL4812131 0.86 MEN1 (0.38) LMNAPOLBPKMMAPTKDM4E
SCHEMBL4813226 0.86 TSHR (0.38) LMNAPOLBPKMMAPTKDM4E
SCHEMBL4814873 0.83 RAB9A (0.43) LMNAPOLBPKMMAPTNPC1
SCHEMBL4814404 0.81 AKT1 (0.36) RAB9ATSHR
SCHEMBL4812957 0.81 AKT1 (0.32) MAPTRAB9AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7388103-B2 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-06-17 US disclosed
US-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 US disclosed
WO-2006045246-A1 CYCLOPENTANE CARBOXYLATE COMPOUNDS, PROCESS AND INTERMEDIATES FOR PREPARING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 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-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof C5, C1S, AKR1C3 LMNA 2659/4885POLB 1500/4885PKM 1113/4885

“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.