SCHEMBL5783286

SCHEMBL5783286

CCOC(=O)c1cn(-c2ccncc2)c(-c2ccc(C)cc2)n1

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 17/20 0.80
GABRB2 P47870 17/20 0.80
MLYCD O95822 1/20 0.66
PTGS2 P35354 1/20 0.59
TARBP2 Q15633 1/20 0.45

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
SCHEMBL5780987 0.90 GABRA2 (0.85) GABRA2GABRB2MLYCDPTGS2
SCHEMBL5784967 0.83 GABRA2 (0.57) GABRA2GABRB2MLYCDPTGS2
SCHEMBL13437647 0.82 GABRA2 (0.95) GABRA2GABRB2MLYCDPTGS2TARBP2
SCHEMBL5784917 0.82 GABRA2 (0.71) GABRA2GABRB2MLYCDPTGS2
SCHEMBL23027867 0.82 GABRA2 (1.00) GABRA2GABRB2MLYCDPTGS2
SCHEMBL5423251 0.81 GABRA2 (0.88) GABRA2GABRB2MLYCDPTGS2TARBP2
SCHEMBL2152521 0.80 GABRA2 (0.75) GABRA2GABRB2
SCHEMBL2942875 0.80 MLYCD (1.00) GABRA2GABRB2MLYCDPTGS2
SCHEMBL5782631 0.79 GABRA2 (0.67) GABRA2GABRB2MLYCDPTGS2
SCHEMBL13437646 0.79 GABRA2 (0.83) GABRA2GABRB2MLYCDPTGS2

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
US-20060189591-A1 Five-membered heterocyclic derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-08-24 US disclosed
EP-1621537-A1 FIVE-MEMBERED HETEROCYCLIC DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-02-01 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-20060189591-A1 Five-membered heterocyclic derivative PTGS1, PTGIS, PTGS2 GABRA2 3363/4885GABRB2 3006/4885MLYCD 2910/4885

“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.