SCHEMBL2206340

SCHEMBL2206340

CCn1c(=O)oc(=O)c2ccsc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.40
ERCC1 P07992 1/20 0.35
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
ERCC4 Q92889 1/20 0.35
ADORA2B P29275 1/20 0.33
PDE7A Q13946 5/20 0.33
PDE1B Q01064 3/20 0.33
ALDH1A1 P00352 1/20 0.33
ADORA1 P30542 2/20 0.32
HPGD P15428 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE7B Q9NP56 1/20 0.31

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
SCHEMBL2207598 0.87 ELANE (0.38) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL5613245 0.84 TDP1 (0.41) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL2207892 0.83 HSD17B10 (0.39) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL1523092 0.80 ALDH1A1 (0.42) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL1523116 0.79 ERCC1 (0.34) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL1523762 0.78 ERCC5 (0.57) ERCC1ERCC5FEN1ERCC4ADORA2B
SCHEMBL23412821 0.77 ELANE (0.36) ELANEADORA2B
SCHEMBL1522426 0.76 FEN1 (0.45) ELANEERCC1ERCC5FEN1ERCC4
SCHEMBL3922160 0.76 KMT2A (0.44) ERCC1ERCC5FEN1ERCC4PDE1B
SCHEMBL5616743 0.73 ELANE (0.34) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7982040-B2 Thienopyridinone compounds and methods of treatment NANOTHERAPEUTICS, INC. (US) 2011-07-19 US disclosed
US-7576211-B2 Synthesis of thienopyridinone compounds and related intermediates EPIX DELAWARE, INC. (US) 2009-08-18 US disclosed
US-20090163537-A1 Thienopyridinone Compounds and Methods of Treatment NANOSHIFT, LLC 2009-06-25 US disclosed
US-7488736-B2 Thienopyridinone compounds and methods of treatment EPIX DELAWARE, INC. (US) 2009-02-10 US disclosed
US-20060084805-A1 Synthesis of thienopyridinone compounds and related intermediates NANOSHIFT, LLC 2006-04-20 US disclosed
US-20050256153-A1 Thienopyridinone compounds and methods of treatment NANOSHIFT, LLC 2005-11-17 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 (3 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-20090163537-A1 Thienopyridinone Compounds and Methods of Treatment HTR5A, GIPR, TBXA2R ELANE 1738/4885ERCC1 1777/4885ERCC5 1966/4885
US-20060084805-A1 Synthesis of thienopyridinone compounds and related intermediates HTR5A, GIPR, HTR1A ELANE 2186/4885ERCC1 1642/4885ERCC5 1759/4885
US-20050256153-A1 Thienopyridinone compounds and methods of treatment HTR5A, GIPR, TBXA2R ELANE 1738/4885ERCC1 1777/4885ERCC5 1966/4885

“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.