SCHEMBL5129707

SCHEMBL5129707

COc1ccc(CNc2nc(-c3ccccn3)nc3sc(C)c(C)c23)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 8/20 0.46
PDE10A Q9Y233 1/20 0.46
HIF1A Q16665 3/20 0.42
BCDIN3D Q7Z5W3 1/20 0.42

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
SCHEMBL5130300 0.93 PDE5A (0.46) PDE5APDE10AHIF1ABCDIN3D
SCHEMBL5130956 0.92 POLB (0.48) HIF1A
SCHEMBL5808228 0.91 POLB (0.44) HIF1A
SCHEMBL5119994 0.90 HIF1A (0.45) PDE5AHIF1A
SCHEMBL5122410 0.89 SMN1; SMN2 (0.42) PDE5APDE10ABCDIN3D
SCHEMBL5128885 0.86 POLB (0.47) HIF1A
SCHEMBL5129540 0.86 PDE5A (0.46) PDE5APDE10AHIF1ABCDIN3D
SCHEMBL5113662 0.85 PDE5A (0.47) PDE5APDE10AHIF1A
SCHEMBL5778488 0.84 MEN1 (0.51) PDE5APDE10A
SCHEMBL5121765 0.84 PRKCI (0.57) PDE5ABCDIN3D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080045529-A1 Use Of Thienopyrimidines MERCK PATENT GMBH (DE) 2008-02-21 US disclosed
US-6110920-A TREATMENT OF CARDIOVASCULAR DISORDERS AND IMPOTENCY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-08-29 US disclosed
EP-0920431-A1 THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 1999-06-09 EP disclosed
WO-1998006722-A1 THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 1998-02-19 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-20080045529-A1 Use Of Thienopyrimidines TIE1, DPYD, TK2 PDE5A 2002/4885PDE10A 3363/4885HIF1A 2022/4885

“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.