SCHEMBL4806319

SCHEMBL4806319

COC(=O)C1(CCc2ccccc2)CCCC1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 2/20 0.38
PKM P14618 1/20 0.38
RECQL P46063 1/20 0.37
ADAM17 P78536 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KCNA3 P22001 1/20 0.36
OPRM1 P35372 1/20 0.36

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
SCHEMBL4814688 0.90 LMNA (0.47) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL4810012 0.88 CHRNA7 (0.43) ALDH1A1MAPTKDM4ESMN1; SMN2MEN1
SCHEMBL4817042 0.88 ADAM17 (0.45) ALDH1A1MAPTKDM4ESMN1; SMN2ADAM17
SCHEMBL4814593 0.88 LMNA (0.37) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL28757465 0.87 ADAM17 (0.40) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL4810365 0.84 BCHE (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL4804758 0.84 L3MBTL1 (0.43) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL18494342 0.84 MAPT (0.41) ALDH1A1MAPTKDM4ESMN1; SMN2LMNA
SCHEMBL4809655 0.82 RAB9A (0.43) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL4808452 0.79 AKT1 (0.35) MAPT

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 ALDH1A1 71/4885MAPT 4766/4885KDM4E 2912/4885

“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.