SCHEMBL8186022

SCHEMBL8186022

Cc1ccc(-n2[nH]cc(-c3cccnc3)c2=O)nc1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VHL P40337 6/20 0.71
P4HTM Q9NXG6 13/20 0.69
EGLN1 Q9GZT9 1/20 0.65
CYP3A4 P08684 1/20 0.50
CYP2A6 P11509 1/20 0.50

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 SCHEMBL3617381 0.99 VHL (0.70) VHLP4HTMEGLN1CYP3A4CYP2A6
SCHEMBL3592741 0.85 VHL (0.71) VHLP4HTMEGLN1
SCHEMBL3595365 0.85 VHL (0.71) VHLP4HTMEGLN1
SCHEMBL3591779 0.85 VHL (0.71) VHLP4HTMEGLN1
SCHEMBL3620822 0.84 P4HTM (0.67) VHLP4HTMEGLN1
SCHEMBL3597325 0.84 VHL (0.71) VHLP4HTMEGLN1CYP2A6
SCHEMBL8199893 0.83 VHL (0.65) VHLP4HTMEGLN1
SCHEMBL3597407 0.83 VHL (1.00) VHLP4HTMEGLN1
Hydrochloric Acid SCHEMBL3612340 0.83 P4HTM (0.66) VHLP4HTMEGLN1
SCHEMBL3599948 0.83 P4HTM (0.72) VHLP4HTMEGLN1

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-2097404-B1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER IP GMBH (DE) 2016-07-27 EP disclosed
US-9085572-B2 4-(pyridin-3-yl)-2(pyridin-2yl)-1,2-dihydro-3H-pyrazol-3-one derivatives as specific HIF-pyrolyl-4-hydroxylase inhibitors for treating cardiovascular and haematological diseases BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-21 US disclosed
US-20120322772-A1 SUBSTITUTED IMIDAZOPYRIMIDINES AND TRIAZOLOPYRIMIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-20 US disclosed
US-20100093803-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER SCHERRING PHARMA AKTIENGELLSCHAFT (DE) 2010-04-15 US disclosed
WO-2008067874-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-12 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 (2 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-20100093803-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF DCK, THPO, QDPR VHL 25/4885P4HTM 412/4885EGLN1 882/4885
US-20120322772-A1 SUBSTITUTED IMIDAZOPYRIMIDINES AND TRIAZOLOPYRIMIDINES PPIP5K2, THPO, DPYD VHL 35/4885P4HTM 657/4885EGLN1 1855/4885

“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.