SCHEMBL1770044

SCHEMBL1770044

O=C(CS(=O)(=O)Cc1ccncc1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 0.53
CYP17A1 P05093 7/20 0.53
ALDH1A1 P00352 3/20 0.53
HSD11B1 P28845 5/20 0.48
P2RX7 Q99572 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL1769963 0.85 HSD11B1 (0.62) CYP19A1CYP17A1ALDH1A1HSD11B1P2RX7
SCHEMBL3323668 0.83 KMT2A (0.47) ALDH1A1HSD11B1P2RX7SMN1; SMN2KMT2A
SCHEMBL3321390 0.80 MEN1 (0.47) CYP19A1CYP17A1ALDH1A1HSD11B1P2RX7
SCHEMBL1770092 0.80 HSD11B1 (0.52) CYP19A1CYP17A1ALDH1A1HSD11B1MEN1
SCHEMBL1770121 0.79 ALDH1A1 (0.43) CYP19A1CYP17A1ALDH1A1HSD11B1P2RX7
SCHEMBL3327784 0.78 ALDH1A1 (0.47) ALDH1A1HSD11B1P2RX7SMN1; SMN2MEN1
SCHEMBL1769931 0.78 HSD11B1 (0.55) ALDH1A1HSD11B1P2RX7SMN1; SMN2HTT
SCHEMBL3323248 0.77 HSD11B1 (0.56) ALDH1A1HSD11B1KMT2A
SCHEMBL12596448 0.76 ALDH1A1 (0.44) CYP19A1CYP17A1ALDH1A1HSD11B1SMN1; SMN2
SCHEMBL1770249 0.75 ALDH1A1 (0.40) CYP19A1CYP17A1ALDH1A1HSD11B1SMN1; SMN2

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 3 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
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 CYP19A1 112/4885CYP17A1 23/4885ALDH1A1 307/4885

“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.