SCHEMBL1991787

SCHEMBL1991787

O=C1NC(=O)C(c2c[nH]c3ccsc23)=C1c1cn(C2CCN3CCOCC3C2)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCG P05129 15/20 0.54
PRKCB P05771 13/20 0.54
PRKCA P17252 13/20 0.54
PRKCE Q02156 11/20 0.54
PRKCD Q05655 10/20 0.54
PRKCH P24723 9/20 0.54
CAMK2D Q13557 9/20 0.54
CAMK2B Q13554 7/20 0.54
CAMK2G Q13555 7/20 0.54
CAMK2A Q9UQM7 7/20 0.54
PRKCZ Q05513 6/20 0.54
SRC P12931 3/20 0.54
PRKACA P17612 3/20 0.44
PRKACG P22612 3/20 0.44
PRKACB P22694 3/20 0.44
GSK3B P49841 7/20 0.41
CDK2 P24941 2/20 0.41
CDK1 P06493 1/20 0.41
PRKCQ Q04759 1/20 0.41
CCNE2 O96020 1/20 0.40

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
SCHEMBL1999506 0.89 PRKCG (0.51) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1991852 0.86 PRKCB (0.59) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1997401 0.86 CAMK2D (0.53) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1994345 0.85 PRKCA (0.40) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1993077 0.79 CAMK2D (0.61) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1993935 0.79 PRKCH (0.49) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1990615 0.78 CAMK2D (0.56) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1996178 0.78 CAMK2D (0.56) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1992525 0.77 CAMK2D (0.57) PRKCGPRKCBPRKCAPRKCEPRKCD
SCHEMBL1989734 0.77 PRKCB (0.59) PRKCGPRKCBPRKCAPRKCEPRKCD

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
WO-2011079105-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-30 WO disclosed
US-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-23 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 (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-20110152243-A1 NOVEL THIENOPYRROLE COMPOUNDS TPMT, TSLP, THPO PRKCG 3728/4885PRKCB 3335/4885PRKCA 3438/4885

“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.