SCHEMBL1770035

SCHEMBL1770035

Cn1cnnc1S(=O)(=O)CC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.57
ALDH1A1 P00352 5/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.38
CYP3A4 P08684 1/20 0.38
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL3319512 0.80 HSD11B1 (0.50) HSD11B1ALDH1A1NPSR1TSHRHPGD
SCHEMBL1770088 0.73 HSD11B1 (1.00) HSD11B1ALDH1A1CYP3A4KDM4ELMNA
SCHEMBL3321222 0.72 HSD11B1 (0.53) HSD11B1ALDH1A1NPSR1HPGDLMNA
SCHEMBL1770092 0.71 HSD11B1 (0.52) HSD11B1ALDH1A1KDM4E
SCHEMBL1770472 0.71 HSD11B1 (0.56) HSD11B1ALDH1A1TSHRHPGDCYP3A4
SCHEMBL1770014 0.69 HSD11B1 (1.00) HSD11B1ALDH1A1NPSR1
SCHEMBL3323351 0.69 NPC1 (0.51) HSD11B1ALDH1A1NPSR1TSHRHPGD
SCHEMBL1770271 0.68 HSD11B1 (0.52) HSD11B1ALDH1A1NPSR1TSHRHPGD
SCHEMBL3321985 0.68 ALDH1A1 (0.65) HSD11B1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL1770013 0.67 HSD11B1 (0.50) HSD11B1ALDH1A1NPSR1CYP3A4KDM4E

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 HSD11B1 1/4885ALDH1A1 307/4885NPSR1 1640/4885

“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.