SCHEMBL1556955

SCHEMBL1556955

CS(=O)(=O)c1ccc2c(c1)CC(=O)N2

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 10/20 0.60
PKM P14618 2/20 0.57
AHR P35869 1/20 0.54
SMYD3 Q9H7B4 1/20 0.53
IDO1 P14902 1/20 0.53
TDP1 Q9NUW8 2/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.49
GRIA1 P42261 1/20 0.49
CACNG8 Q8WXS5 1/20 0.49
PDE3B Q13370 1/20 0.49
PDE3A Q14432 1/20 0.49

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
SCHEMBL15299992 0.86 AHR (0.54) GAAPKMAHRSMYD3TDP1
SCHEMBL14089190 0.85 PKM (0.60) PKMIDO1
SCHEMBL6602558 0.83 GAA (0.57) GAAPKMAHRSMYD3IDO1
SCHEMBL2203244 0.83 GAA (0.64) GAAPKMAHRSMYD3IDO1
SCHEMBL689168 0.83 GAA (0.60) GAAPKMAHRSMYD3IDO1
SCHEMBL10293161 0.83 GAA (0.60) GAAPKMAHRSMYD3IDO1
SCHEMBL517067 0.83 GAA (0.60) GAAPKMAHRSMYD3IDO1
SCHEMBL689118 0.82 PKM (0.64) GAAPKMAHRSMYD3IDO1
SCHEMBL689464 0.82 GAA (0.56) GAAPKMAHRSMYD3IDO1
SCHEMBL12431627 0.82 GAA (0.56) GAAPKMAHRSMYD3IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
US-8344018-B2 Oxindolyl inhibitor compounds GILEAD SCIENCES, INC. (US) 2013-01-01 US disclosed
WO-2012178015-A2 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2012-12-27 WO disclosed
WO-2012178015-A2 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2012-12-27 WO disclosed
US-20110135594-A1 OXINDOLYL INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2011-06-09 US disclosed
EP-2303841-A1 OXINDOLYL INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2011-04-06 EP disclosed
US-7714146-B2 Azulene-oxindole compounds as multiple-kinase inhibitors and useful as anticancer agents INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2010-05-11 US disclosed
WO-2010009166-A1 OXINDOLYL INHIBITOR COMPOUNDS GILEAD COLORADO, INC. (US) 2010-01-21 WO disclosed
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
US-20080125590-A1 Azulene compounds INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2008-05-29 US disclosed
EP-1918277-A2 Azulene compounds Industrial Technology Research Institute (TW) 2008-05-07 EP disclosed
US-20050032871-A1 Sulfonylated pyrrole-2-indolinone derivatives as kinase inhibitors SUGEN, INC. 2005-02-10 US disclosed
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors SUGEN, INC. 2004-09-23 US disclosed
EP-0912557-B1 OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2003-07-09 EP disclosed
US-6265411-B1 ANGIOGENESIS INHIBITOR ZENECA LIMITED (GB) 2001-07-24 US disclosed
EP-0912557-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1999-05-06 EP disclosed
WO-1997042187-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1997-11-13 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 (6 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-20140205537-A1 LRRK2 INHIBITORS LRRK2, PARK7, MAP2 GAA 872/4885PKM 1039/4885AHR 4284/4885
US-20050032871-A1 Sulfonylated pyrrole-2-indolinone derivatives as kinase inhibitors MAP3K20, CDK20, STK10 GAA 1297/4885PKM 283/4885AHR 2417/4885
US-20080125590-A1 Azulene compounds AZI2, PRMT5, BRCA1 GAA 2704/4885PKM 4208/4885AHR 1545/4885
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors REN, ACE, AGTR1 GAA 139/4885PKM 1191/4885AHR 3443/4885
US-20110135594-A1 OXINDOLYL INHIBITOR COMPOUNDS HDAC1, HDAC8, HDAC11 GAA 510/4885PKM 443/4885AHR 1800/4885
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors MAP3K15, MAP3K20, MAP3K19 GAA 3834/4885PKM 951/4885AHR 810/4885

“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.