SCHEMBL2995119

SCHEMBL2995119

CC(C)N1CCC(N(C)C(=O)Cn2c(-c3ccoc3)c(-c3ccccc3)c3sc(C(=O)O)cc32)C1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.38
KCNH2 Q12809 1/20 0.36
MCHR1 Q99705 2/20 0.33
CCR5 P51681 4/20 0.32
F10 P00742 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
SCHEMBL2988692 0.88 MCHR1 (0.42) HRH3KCNH2MCHR1CCR5F10
SCHEMBL2995117 0.87 HRH3 (0.33) HRH3KCNH2MCHR1
SCHEMBL2994236 0.82 GRIN2B (0.35)
SCHEMBL5231280 0.77 HRH3 (0.32) HRH3KCNH2MCHR1
SCHEMBL2989200 0.75 POLB (0.42) MCHR1CCR5
SCHEMBL2988690 0.75 MCHR1 (0.41) HRH3KCNH2MCHR1CCR5
SCHEMBL2997718 0.72 GRIN2B (0.40)
SCHEMBL2994234 0.71 SCN9A (0.38) KCNH2
SCHEMBL5231631 0.70 CHRNB2 (0.38)
SCHEMBL2991825 0.69 MCHR1 (0.37) HRH3KCNH2MCHR1CCR5F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US claimed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP claimed
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 HRH3 1724/4885KCNH2 3782/4885MCHR1 2771/4885

“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.