SCHEMBL6330256

SCHEMBL6330256

CCCC=C1CCC(=CCC(C)C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCHE P06276 2/20 0.35
ACHE P22303 2/20 0.35
PTGS2 P35354 2/20 0.35
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
PRKCA P17252 11/20 0.32
PRKCE Q02156 3/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2B6 P20813 1/20 0.31
CCR6 P51684 1/20 0.30
TRPA1 O75762 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
SCHEMBL6327326 0.89 RAB9A (0.46) RAB9APOLBMAPTKDM4EL3MBTL1
SCHEMBL6330248 0.88 MAPT (0.53) RAB9APOLBMAPTL3MBTL1BCHE
SCHEMBL6332600 0.87 RAB9A (0.43) RAB9APOLBMAPTKDM4EL3MBTL1
SCHEMBL6325231 0.85 KDM4E (0.41) RAB9AKDM4EL3MBTL1BCHEACHE
SCHEMBL6325227 0.85 KDM4E (0.41) RAB9AKDM4EL3MBTL1BCHEACHE
SCHEMBL6331115 0.85 RAB9A (0.35) RAB9APOLBMAPTKDM4EL3MBTL1
SCHEMBL6325301 0.81 RAB9A (0.44) RAB9APOLBMAPTKDM4EL3MBTL1
SCHEMBL6331189 0.78 KDM4E (0.51) RAB9AKDM4EL3MBTL1NFKB1NFKB2
SCHEMBL6331187 0.78 KDM4E (0.51) RAB9AKDM4EL3MBTL1NFKB1NFKB2
SCHEMBL10737938 0.77 CYP1A2 (0.39) RAB9AMAPTKDM4EL3MBTL1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009928-A1 Cyclopentanone derivative ZEON CORPORATION (JP) 2005-01-13 US disclosed
EP-1420005-A1 CYCLOPENTANONE DERIVATIVE Zeon Corporation (JP) 2004-05-19 EP 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-20050009928-A1 Cyclopentanone derivative PTGIS, CYP51A1, TRPA1 RAB9A 4009/4885POLB 1273/4885MAPT 3445/4885

“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.