SCHEMBL12273200

SCHEMBL12273200

COCCN(CCOC)c1ccc2c(c1)SC1=C(N2)C(C#N)=CC(=O)C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 1/20 0.31
▸ SNCA P37840 1/20 0.31
▸ CASP3 P42574 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
SCHEMBL12272899 0.78 CASP3 (0.33) IDH1CASP3
SCHEMBL12812986 0.73 SNCA (0.47) IDH1SNCACASP3
SCHEMBL12273414 0.70 CRHR1 (0.31) —
SCHEMBL12272996 0.69 PDE7B (0.31) —
SCHEMBL12273608 0.69 MAPT (0.34) —
SCHEMBL12273537 0.69 CASP3 (0.34) IDH1CASP3
SCHEMBL5725873 0.68 SNCA (0.41) IDH1SNCACASP3
SCHEMBL12272985 0.67 AR (0.33) —
SCHEMBL15948223 0.66 CRHR1 (0.35) IDH1SNCACASP3
SCHEMBL15948227 0.65 SNCA (0.35) IDH1SNCACASP3

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-8759336-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-06-24 — — US claimed
US-8809317-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-08-19 — — US disclosed
US-8759336-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-06-24 — — US disclosed
US-20120302556-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-11-29 — — US disclosed
WO-2012135402-A1 ANTIVIRAL COMPOUNDS PROSTETTA ANTIVIRAL INC. (US) 2012-10-04 — — WO disclosed
WO-2012125983-A1 ANTIVIRAL TREATMENTS PROSETTA ANTIVIRAL INC. (US) 2012-09-20 — — WO disclosed
US-20120238543-A1 Antiviral Compounds Prosetta Antiviral, Inc. (US) 2012-09-20 — — 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-20120238543-A1 Antiviral Compounds MAVS, EIF2AK2, IRF3 IDH1 333/4885SNCA 1190/4885CASP3 188/4885
US-20120302556-A1 Antiviral Compounds HAVCR2, MAVS, EIF2AK2 IDH1 1101/4885SNCA 734/4885CASP3 193/4885

“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.

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