SCHEMBL3105245

SCHEMBL3105245

Nc1nc(N)nc(NCOCNc2nc(N)nc(N)n2)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
NPSR1 Q6W5P4 1/20 0.35
CASP1 P29466 1/20 0.33
GPR68 Q15743 2/20 0.33
HTR1A P08908 4/20 0.32
DRD2 P14416 4/20 0.32
HTR2A P28223 4/20 0.32
HTR7 P34969 4/20 0.32
HTR6 P50406 4/20 0.32
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
JAK2 O60674 1/20 0.30

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
SCHEMBL28661180 0.89 CA1 (0.36) CA1CA2CA9NPSR1CASP1
SCHEMBL8578645 0.87 CA1 (0.35) CA1CA2CA9NPSR1GPR68
SCHEMBL963512 0.87 TLR8 (0.36) CA1CA2CA9NPSR1NPC1
SCHEMBL3981799 0.83 CA1 (0.37) CA1CA2CA9NPC1RAB9A
SCHEMBL17915969 0.82 TLR8 (0.36) HTR7NPC1RAB9ATP53GLA
SCHEMBL10940908 0.82 CA1 (0.36) CA1CA2CA9CASP1HTR1A
SCHEMBL7108420 0.82 HTR7 (0.33) CA1CA2CA9HTR7HTR6
SCHEMBL8130295 0.82 SMN1; SMN2 (0.33) CA1CA2CA9NPC1RAB9A
SCHEMBL10424897 0.82 CDK1 (0.33) CA1CA2CA9CASP1
SCHEMBL545236 0.81 CA1 (0.37) CA1CA2CA9NPSR1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0106126-B1 METHOD OF PRODUCING THINLY SLICED BIOLOGICAL TISSUE, AND INFILTRATING HARDENING MEANS FOR SUCH A TISSUE Bachhuber, Maria Doris (DE) 1989-05-03 EP claimed
US-4588579-A Process for the production of thin sections of biological tissue Bachhuber, Rolf (DE) 1986-05-13 US claimed
EP-4166711-A1 SOFT HANDLE COMPOSITION Rudolf GmbH (DE) 2023-04-19 EP disclosed
EP-4166710-A1 SOFT FEEL COMPOSITION Rudolf GmbH (DE) 2023-04-19 EP disclosed
CN-107592890-B Hydrophobic compounds and formulations containing them and their use 特克萨帕特有限公司 2020-05-19 CN disclosed
US-20160108577-A1 WATER-REPELLENT FABRICS Barley & Britches, Inc. 2016-04-21 US disclosed
EP-2684694-B1 LAMINATED POLYESTER FILM, MOLDING MEMBER, COMPACT, AND MANUFACTURING METHOD THEREOF TORAY INDUSTRIES (JP) 2016-03-02 EP disclosed
US-9248629-B2 Laminated polyester film, forming member, formed body and manufacturing method thereof TORAY INDUSTRIES, INC. (JP) 2016-02-02 US disclosed
US-8703894-B2 Fluorocarbon polymer-free preparations based on water and/or organic solvents and the use thereof as a finish on flat materials RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) 2014-04-22 US disclosed
EP-2684694-A1 LAMINATED POLYESTER FILM, MOLDING MEMBER, COMPACT, AND MANUFACTURING METHOD THEREOF Toray Industries, Inc. (JP) 2014-01-15 EP disclosed
US-20130344320-A1 LAMINATED POLYESTER FILM, FORMING MEMBER, FORMED BODY AND MANUFACTURING METHOD THEREOF TORAY INDUSTRIES, INC. (JP) 2013-12-26 US disclosed
US-20100190397-A1 FLUOROCARBON POLYMER-FREE PREPARATIONS BASED ON WATER AND/OR ORGANIC SOLVENTS AND THE USE THEREOF AS A FINISH ON FLAT MATERIALS RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) 2010-07-29 US disclosed
US-7354458-B2 Preparations based on water and/or organic solvents and their use as a finish on flat materials RUDOLF GMBH & CO., KG, CHEMISCHE FABRIK (DE) 2008-04-08 US disclosed
US-20060151739-A1 Preparations for making planar structures oil-repellent and water-repellent, and use thereof RUDOLF GMBH & CO. KG (DE) 2006-07-13 US disclosed
US-20050085573-A1 Preparations based on water and/or organic solvents and their use as a finish on flat materials RUDOLF GMBH & CO., KG CHEMISCHE FABRIK 2005-04-21 US disclosed
US-5047065-A Aqueous finishing agent and process for a soft hand, water and oil repellent treatment for fibrous materials: perfluoro-aliphatic agent, polyethylene and modified hydrogen-alkyl-polysiloxane MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-09-10 US disclosed
US-4834764-A Process for obtaining wash-and cleaning resistant textile finishes with reactive perfluoroalkyl-containing (co) polymers and/or precondensates and a blocked isocyanate compound CIBA-GEIGY CORPORATION (US) 1989-05-30 US disclosed
US-4588579-A Process for the production of thin sections of biological tissue Bachhuber, Rolf (DE) 1986-05-13 US disclosed
US-4588579-A Process for the production of thin sections of biological tissue Bachhuber, Rolf (DE) 1986-05-13 US disclosed
US-4406816-A Process for the preparation of microcapsules, and the microcapsules obtained thereby BASF AKTIENGESELLSCHAFT (DE) 1983-09-27 US 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-20100190397-A1 FLUOROCARBON POLYMER-FREE PREPARATIONS BASED ON WATER AND/OR ORGANIC SOLVENTS AND THE USE THEREOF AS A FINISH ON FLAT MATERIALS PIGS, FGB, F8 CA1 3686/4885CA2 4422/4885CA9 956/4885

“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.