SCHEMBL6557303

SCHEMBL6557303

Cc1onc(NS(=O)(=O)c2ccccc2N)c1C

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 5/20 0.48
NFKBIA P25963 1/20 0.46
RELA Q04206 1/20 0.46
SLC40A1 Q9NP59 1/20 0.46
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL30171185 0.83 EDNRA (0.63) EDNRA
SCHEMBL5529599 0.83 EDNRA (0.63) EDNRA
SCHEMBL26688897 0.83 EDNRA (0.63) EDNRA
SCHEMBL25084408 0.81 EDNRA (0.43) EDNRA
SCHEMBL7557151 0.81 EDNRA (0.64) EDNRA
SCHEMBL30637685 0.79 EDNRB (0.59) EDNRA
SCHEMBL6767337 0.77 EDNRA (0.76) EDNRA
SCHEMBL29281026 0.77 EDNRA (0.46) EDNRA
SCHEMBL24822108 0.77 EDNRA (0.46) EDNRASLC40A1
SCHEMBL7588377 0.77 EDNRA (0.45) EDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200038399-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION Motif BioSciences Inc. 2020-02-06 US claimed
EP-3538094-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION Motif Biosciences, Inc. (US) 2019-09-18 EP claimed
WO-2018144086-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION MOTIF BIOSCIENCES, INC. (US) 2018-08-09 WO claimed
US-20180133218-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION HERCULES TECHNOLOGY MANAGEMENT CO III LLC 2018-05-17 US claimed
US-20200038399-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION Motif BioSciences Inc. 2020-02-06 US disclosed
EP-3538094-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION Motif Biosciences, Inc. (US) 2019-09-18 EP disclosed
WO-2018144086-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION MOTIF BIOSCIENCES, INC. (US) 2018-08-09 WO disclosed
US-20180133218-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION HERCULES TECHNOLOGY MANAGEMENT CO III LLC 2018-05-17 US disclosed
EP-1230224-B1 SUBSTITUTED 5-BENZYL-2,4-DIAMINOPYRIMIDINES BASILEA PHARMACEUTICA AG (CH) 2004-12-29 EP disclosed
EP-1278742-B1 CHROMENYLMETHYLPYRIMIDINEDIAMINES AS ANTIBACTERIAL AGENTS BASILEA PHARMACEUTICA AG (CH) 2004-12-15 EP disclosed
US-6821980-B1 Substituted 5-benzyl-2,4-diaminopyrimidines BASILEA PHARMACEUTICA AG (CH) 2004-11-23 US disclosed
US-6818649-B2 5-(8-ALKOXY)-2,2-SUBSTITUTED-2H-CHROMEN-6-YLMETHYL)-PYRIMIDINE-2,4 -DIAMINE DERIVATIVES USEFUL FOR TREATING INFECTIOUS DISEASES BASILEA PHARMACEUTICA AG (CH) 2004-11-16 US disclosed
WO-1997020839-A1 DIAMINOPYRIMIDINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIBACTERIAL F. HOFFMANN-LA ROCHE AG (CH) 1997-06-12 WO disclosed
WO-1996016046-A2 NOVEL BENZYL PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 1996-05-30 WO disclosed
US-4792557-A 2,4-diamino-5[4-amino (or dimethylamino)-3,5-dimethoxybenzyl]pyrimidine and antibacterial composition thereof HOFFMAN-LA ROCHE INC. (US) 1988-12-20 US disclosed
US-4659818-A Intermediates for benzylpyrimidines HOFFMANN-LA ROCHE INC. (US) 1987-04-21 US disclosed
US-4515948-A BACTERICIDES, SULFA DRUG POTENTIATORS HOFFMANN-LA ROCHE INC. (US) 1985-05-07 US disclosed
US-4251454-A MADE FROM ANILINOMETHYLENE CHLORO-AMINO-HYDROCINNAMONITRILE HOFFMANN-LA ROCHE INC. (US) 1981-02-17 US disclosed
US-4076810-A Benzylpyrimidine antibacterial composition HOFFMANN-LA ROCHE INC. (US) 1978-02-28 US disclosed
US-4039543-A SUBSTITUTED BY AMINE, N-RING, AMIDE, CARBAMATE, UREA HOFFMANN-LA ROCHE INC. (US) 1977-08-02 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 (2 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-20180133218-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION NISCH, KIT, MGAM EDNRA 3891/4885NFKBIA 1278/4885RELA 1634/4885
US-20200038399-A1 FORMULATIONS, METHODS, KIT, AND DOSAGE FORMS FOR TREATING BACTERIAL INFECTION NISCH, KIT, MGAM EDNRA 3891/4885NFKBIA 1278/4885RELA 1634/4885

“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.