SCHEMBL3470165

SCHEMBL3470165

CC(C)(C)OC(=O)CC1CNCCN1CC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.37
PLA2G10 O15496 1/20 0.34
PLA2G5 P39877 1/20 0.34
HPGD P15428 1/20 0.32
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA4 P22748 2/20 0.30
CA9 Q16790 2/20 0.30
SIGMAR1 Q99720 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
SCHEMBL30833586 0.82 PARP1 (0.35) PARP1PLA2G10PLA2G5SIGMAR1
SCHEMBL17152994 0.82 PLA2G10 (0.35) PARP1PLA2G10PLA2G5SIGMAR1
SCHEMBL28973166 0.79 GRM2 (0.34) PARP1PLA2G10PLA2G5
SCHEMBL17153120 0.79 PLA2G10 (0.33) PARP1PLA2G10PLA2G5
SCHEMBL8894875 0.77 ZDHHC9 (0.40) PARP1PLA2G10PLA2G5CA1CA2
SCHEMBL31315395 0.75 PLA2G10 (0.36) PARP1PLA2G10PLA2G5
SCHEMBL9098808 0.72 PARP1 (0.50) PARP1
SCHEMBL1149942 0.72 PARP1 (0.50) PARP1
SCHEMBL30426265 0.72 KDM4E (0.37)
SCHEMBL7116763 0.72 SLC6A1 (0.44) CA1CA2CA4CA9

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-8268402-B2 Fullerene film and fullerene polymer both produced from fullerene derivative and processes for producing these FRONTIER CARBON CORPORATION (JP) 2012-09-18 US disclosed
US-20100317767-A1 FULLERENE FILM AND FULLERENE POLYMER BOTH PRODUCED FROM FULLERENE DERIVATIVE AND PROCESSES FOR PRODUCING THESE FRONTIER CARBON CORPORATION (JP) 2010-12-16 US disclosed
EP-2098549-A1 FULLERENE FILM USING FULLERENE DERIVATIVE AS RAW MATERIAL, FULLERENE POLYMER AND THEIR PRODUCTION METHODS Frontier Carbon Corporation (JP) 2009-09-09 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-20100317767-A1 FULLERENE FILM AND FULLERENE POLYMER BOTH PRODUCED FROM FULLERENE DERIVATIVE AND PROCESSES FOR PRODUCING THESE RNF168, FTO, MGMT PARP1 924/4885PLA2G10 1057/4885PLA2G5 2161/4885

“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.