SCHEMBL2069593

SCHEMBL2069593

O=S(=O)(Cc1nc2ccccc2o1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.56
RAB9A P51151 4/20 0.56
MAPT P10636 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 2/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
LOXL2 Q9Y4K0 1/20 0.50
TDP1 Q9NUW8 2/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.45
PTPN2 P17706 1/20 0.45
PTPN1 P18031 1/20 0.45
PTPN5 P54829 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL11336715 0.89 MAPT (0.51) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL11339884 0.86 PTPN2 (0.53) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL11339875 0.84 NPC1 (0.51) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL1272707 0.80 LMNA (0.65) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL1272704 0.80 MAPT (0.59) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL7317192 0.80 MAPT (0.59) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL7306976 0.80 NPC1 (0.59) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL7317735 0.80 MAPT (0.59) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL7317185 0.79 MAPT (0.58) NPC1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL2069838 0.74 NPC1 (0.52) NPC1RAB9AMAPTSMN1; SMN2TP53

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 7 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
US-4039531-A 4-Stilbenyl-1,2,3-triazoles, process for preparing them and their use as optical brighteners HOECHST AKTIENGESELLSCHAFT (DT) 1977-08-02 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 3611/4885MAPT 920/4885
US-20050215577-A1 Tetrahydrocarbazoles and derivatives NR1H3, NR1H2, NR1H4 NPC1 92/4885RAB9A 3611/4885MAPT 920/4885

“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.