SCHEMBL308959

SCHEMBL308959

Cc1cc(C#N)ccc1S(=O)(=O)N1CCN(C(=O)c2cnn3cc(Cl)cnc23)[C@@H](C)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
EGLN1 Q9GZT9 2/20 0.38
TRPV4 Q9HBA0 9/20 0.36
CYP3A4 P08684 2/20 0.35
KCNH2 Q12809 2/20 0.35
EIF4A3 P38919 1/20 0.34
CYP19A1 P11511 1/20 0.34
HCRTR2 O43614 5/20 0.33
HCRTR1 O43613 3/20 0.33
GPR6 P46095 1/20 0.33

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
SCHEMBL309840 0.92 EGLN1 (0.40) HSD11B1EGLN1TRPV4HCRTR2HCRTR1
SCHEMBL309665 0.91 EGLN1 (0.38) HSD11B1EGLN1TRPV4HCRTR2HCRTR1
SCHEMBL309678 0.87 IDH1 (0.45) EGLN1
SCHEMBL2840624 0.81 EGLN1 (0.46) EGLN1TRPV4
SCHEMBL1429761 0.80 EGLN1 (0.38) HSD11B1EGLN1TRPV4CYP19A1HCRTR2
SCHEMBL10042207 0.79 CCR6 (0.44) HSD11B1CYP3A4
SCHEMBL13510913 0.79 EGLN1 (0.40) EGLN1TRPV4
SCHEMBL2834502 0.78 EGLN1 (0.51) EGLN1
SCHEMBL2833231 0.78 EGLN1 (0.39) EGLN1TRPV4HCRTR2HCRTR1GPR6
SCHEMBL1429552 0.78 EGLN1 (0.51) EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313413-B1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES CONVERGENCE PHARMACEUTICALS (GB) 2012-05-16 EP disclosed
EP-2313413-B1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES CONVERGENCE PHARMACEUTICALS (GB) 2012-05-16 EP disclosed
US-8093249-B2 Pyrazolo[1,5-A]pyrimidine-carbonyl-piperazine derivatives Convergence Pharmaceuticals Limited (GB) 2012-01-10 US disclosed
US-8093249-B2 Pyrazolo[1,5-A]pyrimidine-carbonyl-piperazine derivatives Convergence Pharmaceuticals Limited (GB) 2012-01-10 US disclosed
US-20100016330-A1 Novel Derivatives Convergence Pharmaceuticals Limited (GB) 2010-01-21 US disclosed
US-20100016330-A1 Novel Derivatives Convergence Pharmaceuticals Limited (GB) 2010-01-21 US disclosed
WO-2010007074-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2010-01-21 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-20100016330-A1 Novel Derivatives CACNB2, CACNA1B, CACNA1D HSD11B1 4779/4885EGLN1 3078/4885TRPV4 44/4885

“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.