SCHEMBL3619683

SCHEMBL3619683

CC(C)(C)COc1ccc(-n2[nH]cc(-c3cccnc3)c2=O)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 12/20 1.00
VHL P40337 6/20 0.65
EGLN1 Q9GZT9 2/20 0.63
EGLN2 Q96KS0 1/20 0.58

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 SCHEMBL3614649 0.99 P4HTM (0.98) P4HTMVHLEGLN1EGLN2
SCHEMBL17938031 0.82 P4HTM (0.70) P4HTMVHLEGLN1EGLN2
Hydrochloric Acid SCHEMBL17938049 0.82 P4HTM (0.69) P4HTMVHLEGLN1EGLN2
SCHEMBL17938039 0.81 P4HTM (0.69) P4HTMVHLEGLN1
SCHEMBL3624850 0.81 VHL (0.72) P4HTMVHLEGLN1
SCHEMBL8186022 0.81 VHL (0.71) P4HTMVHLEGLN1
SCHEMBL3836020 0.81 P4HTM (0.67) P4HTMVHLEGLN1
Hydrochloric Acid SCHEMBL3622183 0.81 VHL (0.70) P4HTMVHLEGLN1
Hydrochloric Acid SCHEMBL3617381 0.80 VHL (0.70) P4HTMVHLEGLN1
SCHEMBL8182373 0.80 VHL (0.76) 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 8 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
EP-2097404-B1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER IP GMBH (DE) 2016-07-27 EP disclosed
US-8609698-B2 Substituted dipyridyl-dihydropyrazolones and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-12-17 US disclosed
US-20100093803-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER SCHERRING PHARMA AKTIENGELLSCHAFT (DE) 2010-04-15 US disclosed
US-20100093803-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER SCHERRING PHARMA AKTIENGELLSCHAFT (DE) 2010-04-15 US disclosed
EP-2097404-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF Bayer HealthCare AG (DE) 2009-09-09 EP disclosed
WO-2008067874-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-12 WO 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 (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-20100093803-A1 SUBSTITUTED DIPYRIDYL-DIHYDROPYRAZOLONES AND USE THEREOF DCK, THPO, QDPR P4HTM 412/4885VHL 25/4885EGLN1 882/4885

“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.