SCHEMBL631327

SCHEMBL631327

O=C(CI)Nc1ccc(Nc2ccc3cc(S(=O)(=O)O)ccc3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.62
CASP6 P55212 2/20 0.48
NSD2 O96028 1/20 0.48
DUSP3 P51452 1/20 0.48
PTPN5 P54829 1/20 0.48
CASP7 P55210 1/20 0.48
PTPN11 Q06124 1/20 0.48
CA2 P00918 3/20 0.42
CA1 P00915 2/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
NT5E P21589 1/20 0.42
PRMT1 Q99873 2/20 0.42
ATM Q13315 1/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL31720743 1.00 SNCA (0.62) SNCACASP6NSD2DUSP3PTPN5
SCHEMBL29407421 1.00 SNCA (0.62) SNCACASP6NSD2DUSP3PTPN5
SCHEMBL7036230 0.83 PRMT1 (0.51) CA2CA1CA12CA9PRMT1
SCHEMBL15444335 0.82 MAPT (0.59) MAPTMEN1KMT2APOLBL3MBTL1
SCHEMBL6381706 0.82 PRMT1 (0.50) CA2CA1CA12CA9PRMT1
SCHEMBL4349757 0.82 SNCA (0.83) SNCACASP6NSD2DUSP3PTPN5
SCHEMBL7639620 0.81 CASP6 (0.60) SNCACASP6NSD2DUSP3PTPN5
SCHEMBL7213213 0.81 PRMT1 (0.49) CA2CA1CA12CA9PRMT1
Water SCHEMBL5146224 0.81 PRMT1 (0.49) CA2CA1CA12CA9PRMT1
SCHEMBL29668447 0.77 SNCA (1.00) SNCACASP6NSD2DUSP3PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010146366-A1 ASSAYS RELATING TO BIOMIMETIC MEMBRANES AND THEIR USES AQUAPORIN A/S (DK) 2010-12-23 WO claimed
US-20080269317-A1 Compounds for Covalent Binding to MD-2 and Effect on the Immune Response KEMIJSKI INSTITUT (SI) 2008-10-30 US claimed
EP-1335984-A1 DETERMINATION OF HYDROPHOBIC COENZYME A ESTERS AND OTHER LIPIDS USING A BIOSENSOR COMPRISING A MODIFIED COENZYME A- AND ACYL-COA BINDING PROTEIN (ACBP) Biosensor APS (DK) 2003-08-20 EP claimed
US-20020142347-A1 Biosensor BIOSENSOR APS (DK) 2002-10-03 US claimed
WO-2002061096-A1 DETERMINATION OF HYDROPHOBIC COENZYME A ESTERS AND OTHER LIPIDS USING A BIOSENS OR COMPRISING A MODIFIED COENZYME A- AND ACYL- BINDING PROTEIN (ACBP) BIOSENSOR APS (DK) 2002-08-08 WO claimed
WO-2021150578-A1 FLUORESCENTLY-LABELED F-ACTIN PROTEIN BIOSENSORS AND METHODS OF HIGH-THROUGHPUT DRUG DISCOVERY ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-07-29 WO disclosed
EP-2442894-B1 BIOMIMETRIC MEMBRANES AND USES THEREOF AQUAPORIN AS (DK) 2018-04-11 EP disclosed
EP-2651542-B1 A LIQUID MEMBRANE SUITABLE FOR WATER EXTRACTION AQUAPORIN AS (DK) 2017-02-15 EP disclosed
US-20160282357-A1 METHODS AND COMPOSITIONS RELATED TO NUCLEIC ACID BINDING ASSAYS Nubad, LLC 2016-09-29 US disclosed
US-9410186-B2 Methods and compositions related to nucleic acid binding assays NUBAD LLC (US) 2016-08-09 US disclosed
EP-2977097-A1 BIOMETRIC MEMBRANES WITH VESICLES COMPRISIN AQUAPORIN AND USES THEREOF Aquaporin A/S (DK) 2016-01-27 EP disclosed
US-20150360183-A1 BIOMIMETIC MEMBRANES AND USES THEREOF AQUAPORIN A/S (DK) 2015-12-17 US disclosed
WO-2002061096-A1 DETERMINATION OF HYDROPHOBIC COENZYME A ESTERS AND OTHER LIPIDS USING A BIOSENS OR COMPRISING A MODIFIED COENZYME A- AND ACYL- BINDING PROTEIN (ACBP) BIOSENSOR APS (DK) 2002-08-08 WO disclosed
US-20020051996-A1 MODULAR PROTEIN LIBRARIES AND METHODS OF PREPARATION AMYLIN PHARMACEUTICALS, INC. 2002-05-02 US disclosed
EP-0906333-B1 SUBSTRATES AND INHIBITORS OF PROTEOLYTIC ENZYMES MEDIVIR UK LTD (GB) 2001-07-25 EP disclosed
EP-1098658-A1 ENGINEERED PROTEINS FOR ANALYTE SENSING University of Maryland, Baltimore (US) 2001-05-16 EP disclosed
US-6197534-B1 Engineered proteins for analyte sensing UNIVERSITY OF MARYLAND, BALTIMORE 2001-03-06 US disclosed
EP-1009757-A1 MODULAR PROTEIN LIBRARIES AND METHODS OF PREPARATION Gryphon Sciences (US) 2000-06-21 EP disclosed
WO-2000003727-A1 ENGINEERED PROTEINS FOR ANALYTE SENSING UNIVERSITY OF MARYLAND, BALTIMORE (US) 2000-01-27 WO disclosed
WO-1999011655-A1 MODULAR PROTEIN LIBRARIES AND METHODS OF PREPARATION GRYPHON SCIENCES (US) 1999-03-11 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 (1 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-20020051996-A1 MODULAR PROTEIN LIBRARIES AND METHODS OF PREPARATION CXCL12, CCL2, SDF4 SNCA 3658/4885CASP6 4728/4885NSD2 3756/4885

“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.