SCHEMBL2849377

SCHEMBL2849377

CC[C@@]12CCC[C@H]1[C@@H]1CCc3cc(OS(N)(=O)=O)c(OC)cc3[C@H]1CC2

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STS P08842 18/20 0.66
CA2 P00918 4/20 0.66
CA9 Q16790 3/20 0.64

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
SCHEMBL1258790 0.97 STS (0.65) STSCA2CA9
SCHEMBL1259424 0.86 STS (0.62) STSCA2CA9
SCHEMBL4202096 0.85 STS (0.75) STSCA2CA9
SCHEMBL4202099 0.85 STS (0.75) STSCA2CA9
SCHEMBL1259399 0.84 STS (0.62) STSCA2CA9
SCHEMBL1258813 0.84 STS (0.68) STSCA2CA9
SCHEMBL2856714 0.84 ESR1 (0.64) CA2CA9
SCHEMBL2856241 0.84 STS (0.68) STSCA2CA9
SCHEMBL4204963 0.84 STS (0.49) STSCA2CA9
SCHEMBL3383953 0.83 ESR1 (0.49) STSCA2CA9

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
EP-1594884-B1 ANTITUMORAL 18A-HOMOESTRA-1,3,5(10)-TRIEN-3-YL 2-SUBSTITUTED SULFAMATES STERIX LTD (GB) 2010-01-13 EP claimed
US-20060211670-A1 Antitumoral18a-homoestra-1,3,5(10)-trien-3yl 2-substituted sulfamates STERIX LIMITED (GB) 2006-09-21 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-20060211670-A1 Antitumoral18a-homoestra-1,3,5(10)-trien-3yl 2-substituted sulfamates NR5A1, CYP19A1, SULT1E1 STS 16/4885CA2 1454/4885CA9 686/4885

“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.