SCHEMBL306198

SCHEMBL306198

N#Cc1cc(Cn2cncn2)ccc1-c1ccc(OS(N)(=O)=O)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 20/20 1.00
STS P08842 9/20 1.00
CA2 P00918 1/20 0.86

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
SCHEMBL306803 0.93 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306362 0.85 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306123 0.85 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL305979 0.84 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306613 0.82 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306429 0.82 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306503 0.81 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL10172565 0.81 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306459 0.81 CYP19A1 (1.00) CYP19A1STSCA2
SCHEMBL306829 0.78 CYP19A1 (1.00) CYP19A1STSCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093279-B2 Compound STERIX LIMITED (GB) 2012-01-10 US disclosed
US-20100173963-A1 COMPOUND STERIX LIMITED (GB) 2010-07-08 US 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-20100173963-A1 COMPOUND CBR3, CBR1, OXSR1 CYP19A1 605/4885STS 1844/4885CA2 1559/4885

“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.