SCHEMBL4811693

SCHEMBL4811693

CC(=O)OC1CCCC1(Cc1ccccc1)C(=O)OCC(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
EP300 Q09472 1/20 0.36
HIF1A Q16665 1/20 0.36
CREBBP Q92793 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
TACR1 P25103 1/20 0.35
TACR3 P29371 1/20 0.35
ADAM17 P78536 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
SCHEMBL4812897 0.90 HCRTR2 (0.33) KDM4EMEN1KMT2AALDH1A1TSHR
SCHEMBL4809852 0.89 TRPM8 (0.38) ALDH1A1TSHR
SCHEMBL4814593 0.89 LMNA (0.37) KDM4EMEN1KMT2AEP300HIF1A
SCHEMBL4812849 0.88 KDM4E (0.47) KDM4EMEN1KMT2AALDH1A1ADAM17
SCHEMBL4817042 0.87 ADAM17 (0.45) KDM4EALDH1A1TSHRTACR1TACR3
SCHEMBL4812133 0.85 PLA2G1B (0.39) KDM4EMEN1KMT2AALDH1A1TSHR
SCHEMBL4810904 0.85 ALDH1A1 (0.40) KDM4EMEN1KMT2AEP300HIF1A
SCHEMBL4812584 0.83 PLA2G1B (0.36) KDM4EALDH1A1TSHRADAM17
SCHEMBL4812200 0.83 RAB9A (0.41) KDM4EMEN1KMT2AALDH1A1
SCHEMBL4812898 0.81 SLC22A1 (0.38) ALDH1A1TSHR

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 KDM4E 2912/4885MEN1 2837/4885KMT2A 4572/4885

“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.