SCHEMBL2990743

SCHEMBL2990743

COCn1c(-c2ccccc2)c(C2CCCCC2)c2sc(C(=O)O)c(C=O)c21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 3/20 0.33
SLC6A5 Q9Y345 1/20 0.33
GPR35 Q9HC97 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
RAB9A P51151 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
SCHEMBL13211567 0.86 GPR35 (0.32) SLC6A9SLC6A5GPR35PTGDR2ALDH1A1
SCHEMBL2987823 0.84 SLC6A3 (0.34) SLC6A9RAB9A
SCHEMBL2992932 0.83 RECQL (0.34) SLC6A9SLC6A5GPR35ALDH1A1RAB9A
SCHEMBL13211570 0.83 SLC6A9 (0.33) SLC6A9SLC6A5
SCHEMBL2990746 0.82 ALDH1A1 (0.34) ALDH1A1LMNARAB9A
SCHEMBL3001805 0.81 GNRHR (0.38) SLC6A9SLC6A5
SCHEMBL13211571 0.81 SLC6A9 (0.36) SLC6A9SLC6A5ALDH1A1RAB9A
SCHEMBL13211575 0.80 SLC6A9 (0.32) SLC6A9SLC6A5
SCHEMBL2156342 0.78 SGMS2 (0.35) ALDH1A1LMNA
SCHEMBL13211566 0.77 CD274 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US disclosed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP 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-20090036443-A1 Thienopyrroles as antiviral agents ZC3HAV1, XDH, TPMT SLC6A9 3717/4885SLC6A5 3370/4885GPR35 3581/4885

“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.