SCHEMBL8203416

SCHEMBL8203416

O=c1c(-c2cccnc2)c[nH]n1-c1cnccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 13/20 1.00
VHL P40337 7/20 0.78
EGLN1 Q9GZT9 1/20 0.57

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
Hydrochloric Acid SCHEMBL3835307 0.99 P4HTM (0.97) P4HTMVHLEGLN1
SCHEMBL3597407 0.88 VHL (1.00) P4HTMVHLEGLN1
SCHEMBL3597325 0.83 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL3601674 0.83 VHL (0.73) P4HTMVHLEGLN1
SCHEMBL3595365 0.82 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL3591779 0.82 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL8186022 0.82 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL3592741 0.82 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL3588274 0.81 VHL (0.69) P4HTMVHLEGLN1
SCHEMBL8257398 0.81 VHL (1.00) P4HTMVHLEGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089380-B1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER IP GMBH (DE) 2016-06-29 EP disclosed
US-8524699-B2 Substituted dihydropyrazolones and use thereof as HIF-prolyl-4-hydroxylase inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-09-03 US disclosed
US-8524699-B2 Substituted dihydropyrazolones and use thereof as HIF-prolyl-4-hydroxylase inhibitors BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-09-03 US disclosed
US-20120264704-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2012-10-18 US disclosed
US-20120264704-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2012-10-18 US disclosed
WO-2008049538-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-05-02 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-20120264704-A1 SUBSTITUTED DIHYDROPYRAZOLONES AND USE THEREOF AS HIF-PROLYL-4 -HYDROXYLASE INHIBITORS HIF1AN, EGLN3, EGLN2 P4HTM 8/4885VHL 7/4885EGLN1 6/4885

“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.