SCHEMBL6324121

SCHEMBL6324121

CCCCCC1CCC(C2CCCCC2)C1O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
NAAA Q02083 1/20 0.36
EPHX1 P07099 9/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
EPHX2 P34913 2/20 0.34
ALOX5 P09917 1/20 0.34
GBA1 P04062 3/20 0.33
DPP4 P27487 1/20 0.33
SPHK1 Q9NYA1 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
SCHEMBL6322536 0.98 NAAA (0.38) CYP1A2CA1CA2CA4NAAA
SCHEMBL6324978 0.98 CA1 (0.37) CYP1A2CA1CA2CA4NAAA
SCHEMBL6328029 0.97 CHRNB2 (0.38) CA1CA2CA4NAAAEPHX1
SCHEMBL6325157 0.95 CYP1A2 (0.44) CYP1A2CA1CA2CA4NAAA
SCHEMBL6325318 0.93 CYP1A2 (0.41) CYP1A2CA1CA2CA4NAAA
SCHEMBL6325309 0.80 GBA1 (0.33) CYP1A2GBA1
SCHEMBL6331129 0.79 ALOX5 (0.44) EPHX1ALOX5GBA1SPHK1
SCHEMBL6327480 0.78 GBA1 (0.33) CYP1A2GBA1
SCHEMBL6331713 0.77 ALOX5 (0.47) EPHX1ALOX5GBA1SPHK1
SCHEMBL6401737 0.77 ALOX5 (0.47) EPHX1ALOX5GBA1SPHK1

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 CYP1A2 57/4885CA1 3529/4885CA2 2861/4885

“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.