SCHEMBL6324978

SCHEMBL6324978

CCCCCC1CCC(C2CCCC2)C1O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
CYP1A2 P05177 1/20 0.35
ALOX5 P09917 1/20 0.35
GBA1 P04062 6/20 0.34
SPHK1 Q9NYA1 6/20 0.33
SPHK2 Q9NRA0 4/20 0.33
NAAA Q02083 1/20 0.33
GUSB P08236 1/20 0.33
EPHX1 P07099 1/20 0.33

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
SCHEMBL6324121 0.98 CYP1A2 (0.38) CA1CA2CA4CHRNB2CHRNA7
SCHEMBL6328029 0.98 CHRNB2 (0.38) CA1CA2CA4CHRNB2CHRNA7
SCHEMBL6322536 0.97 NAAA (0.38) CA1CA2CA4CHRNB2CHRNA7
SCHEMBL6325318 0.95 CYP1A2 (0.41) CA1CA2CA4CHRNB2CHRNA7
SCHEMBL6325157 0.93 CYP1A2 (0.44) CA1CA2CA4CYP1A2NAAA
SCHEMBL6331129 0.80 ALOX5 (0.44) ALOX5GBA1SPHK1SPHK2GUSB
SCHEMBL6327480 0.79 GBA1 (0.33) CYP1A2GBA1
SCHEMBL6325194 0.78 ALOX5 (0.47) ALOX5GBA1SPHK1SPHK2GUSB
SCHEMBL6401737 0.78 ALOX5 (0.47) ALOX5GBA1SPHK1SPHK2GUSB
SCHEMBL6331713 0.78 ALOX5 (0.47) ALOX5GBA1SPHK1SPHK2GUSB

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 CA1 3529/4885CA2 2861/4885CA4 2063/4885

“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.