SCHEMBL616341

SCHEMBL616341

Clc1ccc2c(c1)NCCS2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
GAA P10253 3/20 0.53
ALDH1A1 P00352 1/20 0.53
VHL P40337 1/20 0.43
ELOC Q15369 1/20 0.43
ELOB Q15370 1/20 0.43
NOX1 Q9Y5S8 2/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
IDO1 P14902 1/20 0.41
RYR2 Q92736 1/20 0.37
MAOA P21397 1/20 0.36
MAPT P10636 4/20 0.36
LMNA P02545 1/20 0.35
CMA1 P23946 1/20 0.34
AHR P35869 1/20 0.34
MAPK13 O15264 1/20 0.34
DAPK3 O43293 1/20 0.34
ROCK2 O75116 1/20 0.34

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
SCHEMBL9032903 0.86 MEN1 (0.55) MEN1KMT2AGAAALDH1A1VHL
SCHEMBL8471402 0.80 NOX1 (0.43) MEN1KMT2AGAAVHLELOC
SCHEMBL6204345 0.77 MEN1 (0.53) MEN1KMT2AGAAALDH1A1IDO1
SCHEMBL1816443 0.77 MEN1 (0.53) MEN1KMT2AGAAALDH1A1RYR2
SCHEMBL10226479 0.77 GAA (0.53) MEN1KMT2AGAAALDH1A1RYR2
SCHEMBL8038619 0.77 MEN1 (0.53) MEN1KMT2AGAAALDH1A1RYR2
SCHEMBL30804421 0.73 RYR2 (0.63) MEN1KMT2AGAAALDH1A1NOX1
SCHEMBL3054155 0.73 ALDH1A1 (0.49) MEN1KMT2AGAAALDH1A1RYR2
SCHEMBL12692912 0.73 ALDH1A1 (0.49) MEN1KMT2AGAAALDH1A1RYR2
SCHEMBL3070838 0.73 MEN1 (0.49) MEN1KMT2AGAAALDH1A1RYR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210023169-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE USING SALMONELLA T3SS EFFECTOR PROTEIN (SipA) UNIVERSITY OF MASSACHUSETTS 2021-01-28 US disclosed
US-10835575-B2 Compositions and methods for treating disease using Salmonella T3SS effector protein (SipA) UNIVERSITY OF MASSACHUSETTS (US) 2020-11-17 US disclosed
US-20190240286-A1 Compositions and Methods for Treating Disease Using Salmonella T3SS Effector Protein (SipA) UNIVERSITY OF MASSACHUSETTS 2019-08-08 US disclosed
US-10201589-B2 Compositions and methods for treating disease using Salmonella T3SS effector protein (SipA) UNIVERSITY OF MASSACHUSETTS (US) 2019-02-12 US disclosed
US-20170035837-A1 Compositions and Methods for Treating Disease Using Salmonella T3SS Effector Protein (SipA) UNIVERSITY OF MASSACHUSETTS (US) 2017-02-09 US disclosed
US-9353218-B2 Kit for multifunctional compounds forming crosslinked biomaterials ANGIOTECH PHARMACEUTICALS, INC. 2016-05-31 US disclosed
US-9326934-B2 Drug delivery from rapid gelling polymer composition ANGIOTECH INTERNATIONAL AG 2016-05-03 US disclosed
EP-2181704-B1 Drug delivery from rapid gelling polymer composition ANGIOTECH INT AG (CH) 2015-05-06 EP disclosed
US-20140140962-A1 VIRUSES MODIFIED WITH UNNATURAL MOIETIES AND METHODS OF USE THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2014-05-22 US disclosed
US-20140086939-A1 COMPOSITIONS AND METHODS FOR DETECTING AND TREATING CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-03-27 US disclosed
US-20040225077-A1 Drug delivery from rapid gelling polymer composition ANGIOTECH INTERNATIONAL AG (CH) 2004-11-11 US disclosed
US-20040219214-A1 Tissue reactive compounds and compositions and uses thereof ANGIOTECH INTERNATIONAL AG (CH) 2004-11-04 US disclosed
US-20040191843-A1 Cell-killing molecules and methods of use thereof PALO ALTO INSTITUTE OF MOLECULAR MEDICINE 2004-09-30 US disclosed
WO-2004060346-A2 DRUG DELIVERY FROM RAPID GELLING POLYMER COMPOSITION ANGIOTECH INTERNATIONAL AG (CH) 2004-07-22 WO disclosed
WO-2004060405-A2 TISSUE REACTIVE COMPOUNDS AND COMPOSITIONS AND USES THEREOF ANGIOTECH INTERNATIONAL AG (CH) 2004-07-22 WO disclosed
US-20030216758-A1 Coated surgical patches ANGIOTECH PHARMACEUTICALS, INC. (CA) 2003-11-20 US disclosed
US-20030144570-A1 Compositions and methods for treating disease utilizing a combination of radioactive therapy and cell-cycle inhibitors ANGIOTECH PHARMACEUTICALS, INC. (CA) 2003-07-31 US disclosed
EP-1235598-A2 COMPOSITIONS OF A COMBINATION OF RADIOACTIVE THERAPY AND CELL-CYCLE INHIBITORS Angiotech Pharmaceuticals, Inc. (CA) 2002-09-04 EP disclosed
US-20020055666-A1 Compositions and methods for treating disease utilizing a combination of radioactive therapy and cell-cycle inhibitors ANGIOTECH INTERNATIONAL AG (CH) 2002-05-09 US disclosed
WO-2001036007-A2 COMPOSITIONS OF A COMBINATION OF RADIOACTIVE THERAPY AND CELL-CYCLE INHIBITORS ANGIOTECH PHARMACEUTICALS, INC. (CA) 2001-05-25 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-20210023169-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE USING SALMONELLA T3SS EFFECTOR PROTEIN (SipA) TP53, CIP2A, ABCC1 MEN1 2845/4885KMT2A 3358/4885GAA 1450/4885
US-20040219214-A1 Tissue reactive compounds and compositions and uses thereof CD44, SELP, EPCAM MEN1 4597/4885KMT2A 4793/4885GAA 3485/4885
US-10835575-B2 Compositions and methods for treating disease using Salmonella T3SS effector protein (SipA) TP53, CIP2A, ABCC1 MEN1 2845/4885KMT2A 3358/4885GAA 1450/4885
US-20190240286-A1 Compositions and Methods for Treating Disease Using Salmonella T3SS Effector Protein (SipA) TP53, CIP2A, ABCC1 MEN1 2845/4885KMT2A 3358/4885GAA 1450/4885
US-20170035837-A1 Compositions and Methods for Treating Disease Using Salmonella T3SS Effector Protein (SipA) TP53, CIP2A, ABCC1 MEN1 2845/4885KMT2A 3358/4885GAA 1450/4885
US-10201589-B2 Compositions and methods for treating disease using Salmonella T3SS effector protein (SipA) TP53, CIP2A, ABCC1 MEN1 2845/4885KMT2A 3358/4885GAA 1450/4885

“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.