SCHEMBL21101217

SCHEMBL21101217

CC(C)C1(C)CNC(=O)NC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
TOP2A P11388 1/20 0.30
TOP2B Q02880 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL22739145 0.77 TOP2A (0.31) SMN1; SMN2TOP2ATOP2BALDH1A1MAPT
SCHEMBL25002627 0.76 SMN1; SMN2 (0.36) SMN1; SMN2
SCHEMBL24884984 0.73 SMN1; SMN2 (0.38) SMN1; SMN2TOP2ATOP2BALDH1A1MAPT
SCHEMBL6318998 0.73
SCHEMBL21101464 0.71 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL23334417 0.69
SCHEMBL3268894 0.69
SCHEMBL21101205 0.69 CRBN (0.32)
SCHEMBL14413826 0.68
SCHEMBL30953503 0.67

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-10428070-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-10-01 US disclosed
US-20190177320-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2019-06-13 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-20190177320-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, SLC10A1, HDGF SMN1; SMN2 4688/4885TOP2A 1098/4885TOP2B 612/4885
US-10428070-B2 Hepatitis B antiviral agents HAVCR2, SLC10A1, HDGF SMN1; SMN2 4688/4885TOP2A 1098/4885TOP2B 612/4885

“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.