SCHEMBL1770485

SCHEMBL1770485

CC(=O)Nc1nnc(S(=O)(=O)CC(=O)C23CC4CC(CC(C4)C2)C3)s1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.70
▸ CA2 P00918 6/20 0.55
▸ CA12 O43570 4/20 0.55
▸ CA1 P00915 4/20 0.55
▸ CA4 P22748 4/20 0.55
▸ CA6 P23280 4/20 0.55
▸ CA5A P35218 4/20 0.55
▸ CA7 P43166 4/20 0.55
▸ CA9 Q16790 4/20 0.55
▸ CA13 Q8N1Q1 4/20 0.55
▸ CA14 Q9ULX7 4/20 0.55
▸ CA5B Q9Y2D0 4/20 0.55
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ CA3 P07451 2/20 0.49
▸ CA11 O75493 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL1770268 0.87 HSD11B1 (0.65) HSD11B1CA2CA12CA1CA4
SCHEMBL1770014 0.82 HSD11B1 (1.00) HSD11B1CA2CA12CA1CA4
SCHEMBL1770128 0.75 HSD11B1 (0.69) HSD11B1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL1770064 0.73 NPC1 (0.49) HSD11B1CA2CA12CA1CA4
SCHEMBL3321985 0.73 ALDH1A1 (0.65) HSD11B1CA2CA12CA1CA9
Acetazolamide Sodium SCHEMBL40813 0.69 CA1 (0.68) CA2CA12CA1CA4CA6
SCHEMBL3619236 0.69 RXFP1 (0.66) CA2CA12CA1CA4CA6
SCHEMBL18100211 0.68 CA1 (0.72) CA2CA12CA1CA4CA6
SCHEMBL9796193 0.68 CA1 (0.61) CA2CA12CA1CA4CA6
SCHEMBL3321222 0.67 HSD11B1 (0.53) HSD11B1KMT2ASMN1; SMN2NPC1RAB9A

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-20110112151-A1 COMPOUND CAPABLE OF INHIBITING 11-BETA HYDROXYSTERIOD DEHYDROGENASE STERIX LIMITED (GB) 2011-05-12 — — US disclosed
US-20110112151-A1 COMPOUND CAPABLE OF INHIBITING 11-BETA HYDROXYSTERIOD DEHYDROGENASE STERIX LIMITED (GB) 2011-05-12 — — 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-20110112151-A1 COMPOUND CAPABLE OF INHIBITING 11-BETA HYDROXYSTERIOD DEHYDROGENASE HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885CA2 602/4885CA12 801/4885

“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.

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