SCHEMBL10077152

SCHEMBL10077152

CCCO[C@H]1CC[C@H](C)C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL13638861 0.87 EPHX2 (0.35) CYP19A1ALDH1A1
SCHEMBL13162616 0.87 EPHX2 (0.35) CYP19A1ALDH1A1
SCHEMBL12094247 0.87 EPHX2 (0.35) CYP19A1ALDH1A1
SCHEMBL10077154 0.87 NPC1 (0.31)
SCHEMBL18033933 0.87 NPC1 (0.31)
SCHEMBL12296 0.87 NPC1 (0.31)
SCHEMBL2668613 0.86 NPC1 (0.31)
SCHEMBL12787632 0.86 NPC1 (0.31)
SCHEMBL24954418 0.83
SCHEMBL12187755 0.83

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-8178531-B2 Antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2012-05-15 US disclosed
US-20110218175-A1 ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2011-09-08 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-20110218175-A1 ANTIVIRAL AGENTS EIF2AK2, HAVCR2, MAVS CYP19A1 3113/4885ALDH1A1 1201/4885

“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.