SCHEMBL6323915

SCHEMBL6323915

CC(C)(C)OC(=O)N(OC(C)(C)C)c1ccc(C#N)s1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.38
CTSS P25774 2/20 0.30
PAX8 Q06710 1/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
PGR P06401 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL6323918 0.84 GPR119 (0.39) GPR119CTSSPAX8CTSLCTSB
SCHEMBL4564052 0.78 CTSS (0.41) GPR119CTSSCTSLCTSBCTSK
SCHEMBL6326366 0.75
SCHEMBL6733518 0.73 HDAC3 (0.47)
SCHEMBL4951324 0.71 GPR119 (0.36) GPR119CTSSCTSLCTSB
SCHEMBL1008388 0.69 PDK1 (0.38)
SCHEMBL5029939 0.68 GRIA2 (0.32) GPR119PGR
SCHEMBL2209533 0.68 ABCB1 (0.37) GPR119
SCHEMBL14907285 0.67 MEN1 (0.40) GPR119PAX8
SCHEMBL4951522 0.67 NR1D1 (0.35) GPR119CTSSCTSLCTSB

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
EP-1423120-A4 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORP (US) 2005-12-28 EP disclosed
US-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 US disclosed
EP-1423120-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2004-06-02 EP disclosed
US-20040087588-A1 Parp inhibitors ICOS CORPORATION 2004-05-06 US disclosed
WO-2003015785-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2003-02-27 WO 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-20040087588-A1 Parp inhibitors PARP1, PARP2, PARP11 GPR119 3328/4885CTSS 2755/4885PAX8 2629/4885

“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.