SCHEMBL22028147

SCHEMBL22028147

CCC1C=CC(=O)C1CC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DNTT P04053 1/20 0.34
SIGMAR1 Q99720 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL15418675 0.85 DNTT (0.32) DNTT
SCHEMBL10385323 0.76
SCHEMBL15418609 0.73 DNTT (0.33) DNTT
SCHEMBL15418617 0.73
SCHEMBL15418833 0.71
SCHEMBL15418748 0.67 DNTT (0.36) DNTT
SCHEMBL9998931 0.67
SCHEMBL10830934 0.66 PPARG (0.39) DNTT
SCHEMBL10627324 0.64 PPARG (0.37) DNTTMEN1KMT2A
SCHEMBL12237081 0.62 NFKB1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117342920-A Chain-substituted tricyclic condensed ring alkane compound and preparation method and application thereof 西北工业大学 2024-01-05 CN claimed
CN-108191599-B Four-membered ring fuel molecule and photochemical preparation method thereof 天津大学 2020-08-04 CN claimed
US-10689309-B1 Fused-ring alkane fuel and photocatalytic preparation process thereof TIANJIN UNIVERSITY (CN) 2020-06-23 US claimed
US-20200181040-A1 Fused-ring alkane fuel and photocatalytic preparation process thereof TIANJIN UNIVERSITY (CN) 2020-06-11 US claimed
CN-108865298-B Fused ring alkane fuel and photocatalytic preparation method thereof 天津大学 2019-07-26 CN claimed
CN-108865298-A Fused ring alkane fuel and photocatalytic preparation method thereof 天津大学 2018-11-23 CN claimed
CN-108191599-A A kind of four-membered ring fuel molecule and its photochemical method for preparation 天津大学 2018-06-22 CN claimed
CN-117342920-A Chain-substituted tricyclic condensed ring alkane compound and preparation method and application thereof 西北工业大学 2024-01-05 CN disclosed
CN-108191599-B Four-membered ring fuel molecule and photochemical preparation method thereof 天津大学 2020-08-04 CN disclosed
US-10689309-B1 Fused-ring alkane fuel and photocatalytic preparation process thereof TIANJIN UNIVERSITY (CN) 2020-06-23 US disclosed
US-20200181040-A1 Fused-ring alkane fuel and photocatalytic preparation process thereof TIANJIN UNIVERSITY (CN) 2020-06-11 US disclosed
CN-108191599-A A kind of four-membered ring fuel molecule and its photochemical method for preparation 天津大学 2018-06-22 CN 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 (2 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-10689309-B1 Fused-ring alkane fuel and photocatalytic preparation process thereof CYP2E1, PDK3, NDUFV1 DNTT 2997/4885SIGMAR1 2995/4885MEN1 2121/4885
US-20200181040-A1 Fused-ring alkane fuel and photocatalytic preparation process thereof CYP2E1, PDK3, NDUFV1 DNTT 2997/4885SIGMAR1 2995/4885MEN1 2121/4885

“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.