SCHEMBL2069738

SCHEMBL2069738

COC(=O)CS(=O)(=O)c1cccc(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.59
MEP1B Q16820 1/20 0.55
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
MTNR1B P49286 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KEAP1 Q14145 2/20 0.48
NFE2L2 Q16236 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
KAT6A Q92794 2/20 0.47
GAA P10253 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL10202538 0.86 HSD11B1 (0.65) HSD11B1MEP1BALDH1A1POLBMTNR1B
SCHEMBL23406130 0.85 SMN1; SMN2 (0.57) HSD11B1MEP1BALDH1A1POLBMTNR1B
SCHEMBL15741700 0.84 HSD11B1 (0.59) HSD11B1MEP1BALDH1A1POLBMTNR1B
SCHEMBL2071026 0.83 KMT2A (0.50) HSD11B1GAA
SCHEMBL1346774 0.81 KAT6A (0.44) HSD11B1ALDH1A1L3MBTL1SMN1; SMN2KAT6A
SCHEMBL2069136 0.81 ATM (0.48) HSD11B1ALDH1A1POLBL3MBTL1KAT6A
SCHEMBL1346427 0.81 CYP1A2 (0.57) GAAPGR
SCHEMBL28555693 0.81 HSD11B1 (0.84) HSD11B1ALDH1A1POLBKEAP1NFE2L2
SCHEMBL1346537 0.80 HTT (0.58) HSD11B1ALDH1A1POLBSMN1; SMN2GAA
SCHEMBL7662115 0.80 F2 (0.55) HSD11B1MEP1BALDH1A1SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7906546-B2 Tetrahydrocarbazoles and derivatives HOFFMANN-LA ROCHE INC. (US) 2011-03-15 US disclosed
US-20100216833-A1 TETRAHYDROCARBAZOLES AND DERIVATIVES DEHMLOW HENRIETTA 2010-08-26 US disclosed
EP-1732892-B1 TETRAHYDROCARBAZOLES AND DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-09-17 EP disclosed
EP-1732892-A1 TETRAHYDROCARBAZOLES AND DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2006-12-20 EP disclosed
WO-2005092856-A1 TETRAHYDROCARBAZOLES AND DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-10-06 WO disclosed
US-20050215577-A1 Tetrahydrocarbazoles and derivatives HOFFMANN-LA ROCHE INC. 2005-09-29 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 (2 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-20100216833-A1 TETRAHYDROCARBAZOLES AND DERIVATIVES NR1H3, NR1H2, NR1H4 HSD11B1 47/4885MEP1B 3405/4885ALDH1A1 3812/4885
US-20050215577-A1 Tetrahydrocarbazoles and derivatives NR1H3, NR1H2, NR1H4 HSD11B1 47/4885MEP1B 3405/4885ALDH1A1 3812/4885

“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.