SCHEMBL12765754

SCHEMBL12765754

O=C1CC2CC3CC1CC(Cl)(C2)C3

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
EPHX2 P34913 2/20 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
SCHEMBL12765773 0.79 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL232917 0.79 EPHX2 (0.47) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL12765514 0.76 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL12837943 0.74 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL192524 0.72 GRIN2D (0.44) SMN1; SMN2EPHX2
SCHEMBL12765518 0.72 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL12765761 0.72 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL13977492 0.72 EPHX2 (0.42) EPHX2
SCHEMBL13968178 0.72 GRIN2D (0.57) SMN1; SMN2EPHX2
SCHEMBL12765501 0.71 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2EPHX2

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-20110065762-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 US disclosed
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 3877/4885SMN1; SMN2 2955/4885EPHX2 3743/4885

“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.