SCHEMBL1993738

SCHEMBL1993738

CN1CCC(Cn2nc(C3=C(c4c[nH]c5ccsc45)C(=O)NC3=O)c3ccccc32)C(F)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 4/20 0.46
PRKACA P17612 1/20 0.43
PRKACG P22612 1/20 0.43
PRKACB P22694 1/20 0.43
PRKCA P17252 13/20 0.41
PRKCB P05771 12/20 0.41
PRKCD Q05655 10/20 0.41
PRKCH P24723 8/20 0.41
PRKCE Q02156 8/20 0.41
PRKCG P05129 7/20 0.41
PRKCZ Q05513 2/20 0.41
CAMK2B Q13554 2/20 0.41
CAMK2G Q13555 2/20 0.41
CAMK2A Q9UQM7 2/20 0.41
SRC P12931 1/20 0.41
GSK3B P49841 9/20 0.39
KCNH2 Q12809 1/20 0.39
PRKCQ Q04759 7/20 0.39
PDPK1 O15530 1/20 0.39
DYRK3 O43781 1/20 0.39

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
SCHEMBL1990379 0.89 CAMK2D (0.45) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1998189 0.89 CAMK2D (0.45) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1993213 0.87 PRKACA (0.56) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1994516 0.86 CAMK2D (0.46) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1993093 0.85 PRKCA (0.42) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1993325 0.85 PRKACA (0.58) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1991967 0.85 CAMK2D (0.46) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1990920 0.84 CAMK2D (0.47) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1990902 0.84 CAMK2D (0.50) CAMK2DPRKACAPRKACGPRKACBPRKCA
SCHEMBL1997364 0.83 CAMK2D (0.47) CAMK2DPRKACAPRKACGPRKACBPRKCA

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 CAMK2D 2963/4885PRKACA 947/4885PRKACG 1317/4885

“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.