SCHEMBL2986277

SCHEMBL2986277

Cc1ccnc(NS(=O)(=O)c2ccccc2N)n1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.65
MAPT P10636 1/20 0.62
CYP2C9 P11712 1/20 0.62
ALDH1A1 P00352 1/20 0.58
NFKBIA P25963 2/20 0.55
RELA Q04206 2/20 0.55
SLC40A1 Q9NP59 2/20 0.55
MAPK1 P28482 1/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
FASN P49327 1/20 0.50
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL3644476 0.84 TSHR (0.62) ALDH1A1NFKBIARELASLC40A1KMT2A
SCHEMBL3837982 0.83 NFKBIA (0.60) CYP2C9ALDH1A1NFKBIARELASLC40A1
SCHEMBL11272841 0.82 NFKBIA (0.48) NPSR1MAPTCYP2C9ALDH1A1NFKBIA
SCHEMBL10888517 0.82 NFKBIA (0.58) CYP2C9ALDH1A1NFKBIARELASLC40A1
SCHEMBL21753211 0.79 NPSR1 (1.00) NPSR1MAPTCYP2C9ALDH1A1MAPK1
SCHEMBL6557188 0.79 SLC40A1 (0.48) NPSR1MAPTCYP2C9ALDH1A1NFKBIA
SCHEMBL11269034 0.78 SLC40A1 (0.49) CYP2C9ALDH1A1NFKBIARELASLC40A1
Sulfamerazine SCHEMBL29538415 0.77 MAPT (1.00) NPSR1MAPTCYP2C9ALDH1A1MAPK1
Sulfamerazine SCHEMBL33999 0.77 MAPT (1.00) NPSR1MAPTCYP2C9ALDH1A1MAPK1
Sulfamerazine SCHEMBL93591 0.75 MAPT (0.97) NPSR1MAPTCYP2C9ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6099864-A In situ activation of microcapsules THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-08-08 US claimed
WO-1999059554-A1 IN SITU ACTIVATION OF MICROCAPSULES NASA/JOHNSON SPACE CENTER (US) 1999-11-25 WO claimed
US-4315931-A MICROBIOCIDES, INFECTIOUS DISEASES BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US claimed
EP-4125840-A1 COMPOUNDS FOR USE IN THE TREATMENT OF SYNUCLEINOPATHIES Som Innovation Biotech, S.A. (ES) 2023-02-08 EP disclosed
WO-2021191417-A1 COMPOUNDS FOR USE IN THE TREATMENT OF SYNUCLEINOPATHIES SOM INNOVATION BIOTECH, S.A. (ES) 2021-09-30 WO disclosed
US-7766979-B2 Controlled transformation of a solid to another solid crystalline phase by subjecting the solid to a tribochemical treatmentcomprising the transmissioon of high kinetic energies or >20 G;purifying a solvated polymorph drug to a solvent-free form byhigh kinetic energy ball milling AVANTIUM INTERNATIONAL B.V. (NL) 2010-08-03 US disclosed
US-20070202024-A1 Phase transformation in molecular solids AVANTIUM INTERNATIONAL B.V. 2007-08-30 US disclosed
EP-1720517-A1 PHASE TRANSFORMATION IN MOLECULAR SOLIDS Avantium International B.V. (NL) 2006-11-15 EP disclosed
WO-2005072699-A1 PHASE TRANSFORMATION IN MOLECULAR SOLIDS AVANTIUM INTERNATIONAL B.V. (NL) 2005-08-11 WO disclosed
US-6099864-A In situ activation of microcapsules THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-08-08 US disclosed
WO-1999059554-A1 IN SITU ACTIVATION OF MICROCAPSULES NASA/JOHNSON SPACE CENTER (US) 1999-11-25 WO disclosed
US-4333936-A Novel amidino-benzylpyrimidines, processes for their manufacture and antibacterial and antiprotozoal use thereof BASF AKTIENGESELLSCHAFT (DE) 1982-06-08 US disclosed
US-4315931-A MICROBIOCIDES, INFECTIOUS DISEASES BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed
EP-0043055-A1 Combinations of therapeutically active substances, process for their manufacture and their use and means containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-01-06 EP disclosed
EP-0000335-B1 ESTERS OF N-PYRIMIDINYL-CARBOXIMIDIC ACID, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM. BASF Aktiengesellschaft (DE) 1981-10-07 EP disclosed
EP-0000336-B1 N-BENZYLPYRIMIDINYL-AMIDINES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM BASF Aktiengesellschaft (DE) 1981-04-15 EP disclosed
EP-0000336-A1 N-benzylpyrimidinyl-amidines, process for their preparation and medicines containing them BASF Aktiengesellschaft (DE) 1979-01-24 EP disclosed
US-4011332-A RODENTICIDE BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-03-08 US disclosed