SCHEMBL2069438

SCHEMBL2069438

Cc1nnc(CS(=O)(=O)c2ccccc2)o1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.65
RAB9A P51151 3/20 0.65
TDP1 Q9NUW8 1/20 0.65
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
QPCT Q16769 1/20 0.47
PSIP1 O75475 1/20 0.46
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.41
HSD11B1 P28845 1/20 0.41

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
SCHEMBL2069309 0.82 NPC1 (0.47) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2069839 0.82 NPC1 (0.47) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2069511 0.80 NPC1 (0.57) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL10108701 0.78 NPC1 (0.55) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2070814 0.76 NPC1 (0.53) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2069838 0.75 NPC1 (0.52) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2069975 0.75 CYP2D6 (0.53) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL2069519 0.73 NPC1 (0.50) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL13915553 0.72 TDP1 (0.34) NPC1RAB9ATDP1LMNA
SCHEMBL14168537 0.72 NPC1 (0.49) NPC1RAB9ATDP1MEN1KMT2A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1938273-B Tetrahydrocarbazoles and derivatives HOFFMAN-LA ROCHE LTD. (CH) 2011-12-14 CN disclosed
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
CN-1938273-A Tetrahydrocarbazoles and derivatives HOFFMANN LA ROCHE (CH) 2007-03-28 CN 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 NPC1 92/4885RAB9A 3611/4885TDP1 3388/4885
US-20050215577-A1 Tetrahydrocarbazoles and derivatives NR1H3, NR1H2, NR1H4 NPC1 92/4885RAB9A 3611/4885TDP1 3388/4885

“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.