SCHEMBL15922889

SCHEMBL15922889

CCCCC1(N)C2CC3CC(C2)CC1C3

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.31
GRIN3B O60391 2/20 0.31
GRIN1 Q05586 2/20 0.31
GRIN2A Q12879 2/20 0.31
GRIN2B Q13224 2/20 0.31
GRIN2C Q14957 2/20 0.31
GRIN3A Q8TCU5 2/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EPHX2 P34913 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
SCHEMBL15922888 1.00 GRIN2D (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15922573 0.94 EPHX2 (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15922575 0.94 EPHX2 (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17352351 0.92 EPHX2 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL2803563 0.87 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL15937107 0.86 GRIN2D (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1349916 0.81 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL4712177 0.79 EPHX2 (0.39) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL4710638 0.79 EPHX2 (0.39) ALDH1A1SMN1; SMN2EPHX2
SCHEMBL6526108 0.77 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9840465-B2 Antiviral compounds UNIV BRIGHAM YOUNG (US) 2017-12-12 US disclosed
US-9840465-B2 Antiviral compounds UNIV BRIGHAM YOUNG (US) 2017-12-12 US disclosed
US-20150368196-A1 ANTIVIRAL COMPOUNDS UNIV BRIGHAM YOUNG (US) 2015-12-24 US disclosed
US-20150368196-A1 ANTIVIRAL COMPOUNDS UNIV BRIGHAM YOUNG (US) 2015-12-24 US disclosed
EP-2950789-A2 ANTIVIRAL COMPOUNDS Brigham Young University (US) 2015-12-09 EP disclosed
WO-2014121170-A2 ANTIVIRAL COMPOUNDS BRIGHAM YOUNG UNIVERSITY (US) 2014-08-07 WO disclosed
WO-2014121170-A2 ANTIVIRAL COMPOUNDS BRIGHAM YOUNG UNIVERSITY (US) 2014-08-07 WO 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-20150368196-A1 ANTIVIRAL COMPOUNDS ACE, ADA, MAVS GRIN2D 4607/4885GRIN3B 3613/4885GRIN1 3204/4885

“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.