SCHEMBL354297

SCHEMBL354297

O=S(=O)(O)CCCN1CC=C(c2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.58
HTR1A P08908 1/20 0.54
PARP1 P09874 4/20 0.52

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
SCHEMBL918408 0.86 SIGMAR1 (0.60) SIGMAR1HTR1APARP1
SCHEMBL918431 0.86 SIGMAR1 (0.60) SIGMAR1HTR1APARP1
SCHEMBL9726233 0.81 SIGMAR1 (0.61) SIGMAR1HTR1A
SCHEMBL10231292 0.80 SIGMAR1 (0.68) SIGMAR1HTR1A
SCHEMBL917378 0.80 HTR7 (0.38) SIGMAR1
SCHEMBL3314489 0.78 SIGMAR1 (0.46) SIGMAR1
SCHEMBL9867159 0.78 SIGMAR1 (0.60) SIGMAR1HTR1A
SCHEMBL5541146 0.78 SIGMAR1 (0.60) SIGMAR1HTR1A
SCHEMBL9726237 0.78 SIGMAR1 (0.60) SIGMAR1HTR1A
SCHEMBL14601668 0.78 SIGMAR1 (0.60) SIGMAR1HTR1A

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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140107027-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES BHI LIMITED PARTNERSHIP (CA) 2014-04-17 US claimed
JP-4726304-B2 2011-07-20 JP claimed
US-7786174-B2 Methods and compounds for inhibiting amyloid deposits BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2010-08-31 US claimed
US-7598269-B2 Methods and compositions for treating amyloid-related diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2009-10-06 US claimed
EP-1276483-B1 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES BELLUS HEALTH INT LTD (CH) 2009-09-02 EP claimed
US-20080015180-A1 Methods and compositions for treating amyloid-related diseases NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-01-17 US claimed
JP-2007516939-A 2007-06-28 JP claimed
US-20070015737-A1 Compounds for inhibiting diseases and preparing cells for transplantation NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-01-18 US claimed
US-20070010573-A1 Methods and compositions for treating amyloid-related diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2007-01-11 US claimed
EP-1644325-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES Neurochem (International) Limited (CH) 2006-04-12 EP claimed
US-20050038117-A1 Methods and compositions for treating amyloid-related diseases NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2005-02-17 US claimed
WO-2004113275-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2004-12-29 WO claimed
JP-2003517458-A 2003-05-27 JP claimed
EP-1303311-A2 AMYLOID TARGETING IMAGING AGENTS AND USES THEREOF Neurochem, Inc. (CA) 2003-04-23 EP claimed
EP-1276483-A2 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 2003-01-22 EP claimed
EP-1237547-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2002-09-11 EP claimed
US-20020115717-A1 Amyloid targeting imaging agents and uses thereof NEUROCHEM (INTERNATIONAL) LIMITED (GI) 2002-08-22 US claimed
WO-2002007781-A2 AMYLOID TARGETING IMAGING AGENTS AND USES THEREOF NEUROCHEM INC. (CA) 2002-01-31 WO claimed
WO-2001003680-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2001-01-18 WO claimed
WO-2000064420-A2 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 2000-11-02 WO claimed

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-20050038117-A1 Methods and compositions for treating amyloid-related diseases APP, PSEN1, PSEN2 SIGMAR1 3810/4885HTR1A 2420/4885PARP1 3930/4885
US-20020115717-A1 Amyloid targeting imaging agents and uses thereof APP, APBA1, BACE1 SIGMAR1 2251/4885HTR1A 3414/4885PARP1 3564/4885
US-20070015737-A1 Compounds for inhibiting diseases and preparing cells for transplantation IAPP, IDE, APP SIGMAR1 4785/4885HTR1A 4619/4885PARP1 4430/4885
US-20140107027-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES APP, PSEN1, PSEN2 SIGMAR1 3888/4885HTR1A 2510/4885PARP1 3977/4885
US-20070010573-A1 Methods and compositions for treating amyloid-related diseases APP, PSEN1, PSEN2 SIGMAR1 3888/4885HTR1A 2510/4885PARP1 3977/4885
US-20080015180-A1 Methods and compositions for treating amyloid-related diseases APP, PSEN1, PSEN2 SIGMAR1 3810/4885HTR1A 2420/4885PARP1 3930/4885

“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.