SCHEMBL12765657

SCHEMBL12765657

O/N=C1/CC2CC3CC(C2)CC1C3

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 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
SCHEMBL13721763 0.78
SCHEMBL17988284 0.78
SCHEMBL9875720 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9875715 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL12765485 0.75
SCHEMBL12765742 0.73
SCHEMBL13968156 0.72 LMNA (0.46) LMNATSHR
SCHEMBL12765761 0.72 ALDH1A1 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL13834253 0.71 LMNA (0.48) LMNATSHR
Hydrochloric Acid SCHEMBL13834252 0.71 LMNA (0.48) LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110065762-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 US 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-20110065762-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS MAVS, SLC30A5, HAVCR2 ALDH1A1 3877/4885KDM4E 2801/4885LMNA 1701/4885

“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.