SCHEMBL21064155

SCHEMBL21064155

CCCCCC(C)(C)C1CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 15/20 0.43
GNAI3 P08754 14/20 0.43
GNAI1 P63096 14/20 0.43
EPHX1 P07099 1/20 0.37

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
SCHEMBL18673262 0.98 GNAO1 (0.46) GNAO1GNAI3GNAI1EPHX1
SCHEMBL26060490 0.98 GNAO1 (0.46) GNAO1GNAI3GNAI1EPHX1
SCHEMBL19375749 0.94 GNAO1 (0.40) GNAO1GNAI3GNAI1EPHX1
SCHEMBL21372058 0.88 GNAO1 (0.41) GNAO1GNAI3GNAI1EPHX1
SCHEMBL22023908 0.86 GNAO1 (0.43) GNAO1GNAI3GNAI1EPHX1
SCHEMBL20012662 0.85 GNAO1 (0.34) GNAO1GNAI3GNAI1
SCHEMBL5171549 0.83 CYP1A2 (0.43)
SCHEMBL24435761 0.82 GNAO1 (0.46) GNAO1GNAI3GNAI1EPHX1
SCHEMBL21180109 0.82 GNAO1 (0.46) GNAO1GNAI3GNAI1EPHX1
SCHEMBL18609539 0.82 GNAO1 (0.46) GNAO1GNAI3GNAI1EPHX1

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-11058678-B2 Substituted heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-07-13 US disclosed
US-10307425-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON (US) 2019-06-04 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 (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-10307425-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis and other apicomplexan protozoan related diseases PNCK, CAMKK1, CILK1 GNAO1 1534/4885GNAI3 1021/4885GNAI1 999/4885
US-11058678-B2 Substituted heterocycles as antiviral agents HCCS, HDGF, HAVCR2 GNAO1 1951/4885GNAI3 446/4885GNAI1 258/4885

“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.