SCHEMBL6534858

SCHEMBL6534858

CNc1ccccc1S(=O)(=O)c1ccccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.62
HSD11B1 P28845 4/20 0.49
AKR1B1 P15121 1/20 0.41
PTGES2 Q9H7Z7 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SLC40A1 Q9NP59 1/20 0.40
ABCC9 O60706 1/20 0.40
ABCC8 Q09428 1/20 0.40
KCNJ11 Q14654 1/20 0.40
KCNJ8 Q15842 1/20 0.40
CNR2 P34972 1/20 0.39
EDNRA P25101 1/20 0.38

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
SCHEMBL11840111 0.88 HTR6 (0.77) HTR6L3MBTL1GAAHSD17B10ALDH1A1
SCHEMBL248010 0.82 HSD11B1 (0.59) HSD11B1AKR1B1L3MBTL1GAATSHR
SCHEMBL2123876 0.82 HSD11B1 (0.59) HSD11B1AKR1B1L3MBTL1GAATSHR
SCHEMBL30697126 0.82 HSD11B1 (0.59) HSD11B1AKR1B1L3MBTL1GAATSHR
SCHEMBL6534886 0.78 HTR6 (0.62) HTR6AKR1B1L3MBTL1EDNRA
SCHEMBL14372093 0.77 HTR6 (1.00) HTR6L3MBTL1GAATSHRHSD17B10
SCHEMBL9806733 0.75 HTR6 (0.59) HTR6L3MBTL1GAATSHRHSD17B10
SCHEMBL6957722 0.74 HTR6 (0.62) HTR6PTGES2L3MBTL1HSD17B10ALDH1A1
SCHEMBL3409083 0.74 HSD11B1 (0.52) HSD11B1AKR1B1L3MBTL1GAATSHR
SCHEMBL2634765 0.74 HTR6 (0.62) HTR6L3MBTL1HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1011652-A4 NOVEL DIARYLSULFONE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS UNIV THE SCIENCES IN PHILADELP (US) 2004-12-22 EP disclosed
US-6303630-B1 TREATING HUMAN IMMUNODEFICIENCY VIRUS INFECTION BYADMINISTERING TO A HUMAN DIARYLSULFONE COMPOUND UNIVERSITY OF THE SCIENCES IN PHILADELPHIA 2001-10-16 US disclosed
EP-1011652-A1 NOVEL DIARYLSULFONE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS University of the Sciences in Philadelphia (US) 2000-06-28 EP disclosed
US-6063790-A TREATMENT OF AIDS UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) 2000-05-16 US disclosed
WO-1999006037-A1 NOVEL DIARYLSULFONE NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) 1999-02-11 WO disclosed