SCHEMBL6339237

SCHEMBL6339237

COc1cc(NS(=O)(=O)c2ccc3c(c2)CCN3C)cc(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
THRB P10828 2/20 0.54
LMNA P02545 2/20 0.54
HTT P42858 2/20 0.53
RXFP1 Q9HBX9 1/20 0.53
TP53 P04637 2/20 0.50
KDM1A O60341 1/20 0.50
MAPT P10636 1/20 0.50
TRIM24 O15164 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 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
SCHEMBL31687130 1.00 SMN1; SMN2 (0.54) SMN1; SMN2THRBLMNAHTTRXFP1
SCHEMBL6348438 0.85 SMN1; SMN2 (0.52) SMN1; SMN2THRBLMNAHTTTP53
SCHEMBL6752057 0.84 KMT2A (0.51) SMN1; SMN2LMNATP53TRIM24MEN1
SCHEMBL6342178 0.80 CYP1A1 (0.50) SMN1; SMN2THRBLMNATP53MAPT
Antiarol SCHEMBL7467110 0.76 CYP1A1 (0.46) SMN1; SMN2THRBLMNATP53MAPT
SCHEMBL6341219 0.76 LMNA (0.79) SMN1; SMN2LMNAHTTMAPTMEN1
SCHEMBL6341641 0.75 THRB (0.53) SMN1; SMN2THRBLMNAHTTTP53
SCHEMBL6350411 0.74 HTR6 (0.65) SMN1; SMN2THRBLMNAHTTTP53
SCHEMBL6048148 0.73 CYP19A1 (0.65) SMN1; SMN2LMNAHTT
SCHEMBL28864522 0.73 LMNA (0.68) SMN1; SMN2THRBLMNAHTTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187246-A1 Cell proliferation inhibitors LI QUN (US) 2005-08-25 US claimed
EP-1181269-B1 CELL PROLIFERATION INHIBITORS ABBOTT LAB (US) 2004-02-25 EP claimed
US-20030096856-A1 Cell proliferation inhibitors ABBVIE INC. 2003-05-22 US claimed
US-20030078439-A1 Process for the preparation of cell proliferation inhibitors ABBVIE INC. 2003-04-24 US claimed
WO-2002024648-A2 PROCESS FOR THE PREPARATION OF CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-03-28 WO claimed
EP-1181269-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-02-27 EP claimed
WO-2000073264-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2000-12-07 WO claimed
US-20050187246-A1 Cell proliferation inhibitors LI QUN (US) 2005-08-25 US disclosed
US-6924304-B2 Cell proliferation inhibitors ABBOTT LABORATORIES (US) 2005-08-02 US disclosed
US-6710185-B2 REACTING N-FORMYLINDOLINE WITH CHLOROSULFONIC ACID AND THIONYL CHLORIDE; AND REACTING THE PRODUCT WITH SODIUM BICARBONATE AND AN ANILINE COMPOUND ABBOTT LABORATORIES 2004-03-23 US disclosed
EP-1181269-B1 CELL PROLIFERATION INHIBITORS ABBOTT LAB (US) 2004-02-25 EP disclosed
US-20030096856-A1 Cell proliferation inhibitors ABBVIE INC. 2003-05-22 US disclosed
US-20030078439-A1 Process for the preparation of cell proliferation inhibitors ABBVIE INC. 2003-04-24 US disclosed
US-6521658-B1 Cell proliferation inhibitors ABBOTT LABORATORIES 2003-02-18 US disclosed
WO-2002024648-A2 PROCESS FOR THE PREPARATION OF CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-03-28 WO disclosed
EP-1181269-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-02-27 EP disclosed
WO-2000073264-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2000-12-07 WO 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 (3 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-20030078439-A1 Process for the preparation of cell proliferation inhibitors MKI67, CCNI, CDKN1A SMN1; SMN2 3964/4885THRB 2103/4885LMNA 1447/4885
US-20030096856-A1 Cell proliferation inhibitors MKI67, CCNI, CCNA1 SMN1; SMN2 1869/4885THRB 2495/4885LMNA 1086/4885
US-20050187246-A1 Cell proliferation inhibitors MKI67, CCNI, CCNC SMN1; SMN2 2093/4885THRB 2012/4885LMNA 1211/4885

“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.