SCHEMBL7603424

SCHEMBL7603424

CCCCCn1nn[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.38
PTGS1 P23219 3/20 0.37
PTGS2 P35354 3/20 0.37
MGLL Q99685 2/20 0.37
FAAH O00519 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.35
ALOX5 P09917 2/20 0.34
HCAR3 P49019 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
SCHEMBL13315556 0.94 TOP2A (0.37) SLC9A1ALDH1A1GAAMAPTHCAR3
SCHEMBL1248798 0.78 ALDH1A1 (0.39) SLC9A1ALDH1A1GAAMAPTTHRB
SCHEMBL8915689 0.77 XDH (0.32)
SCHEMBL2727337 0.72 ALDH1A1 (0.42) SLC9A1ALDH1A1GAALMNA
SCHEMBL8684823 0.69
SCHEMBL6360026 0.69
SCHEMBL7783961 0.68 CYP19A1 (0.43) ALDH1A1MAPT
SCHEMBL19135116 0.68 NFE2L2 (0.33)
SCHEMBL5486374 0.68 ADORA2B (0.42) SLC9A1PTGS1PTGS2MGLLFAAH
SCHEMBL2826206 0.67 ADORA2B (0.44) SLC9A1PTGS1PTGS2MGLLFAAH

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-20210206732-A1 Process for the Production of Tetrazolinones DYNAMIT NOBEL GMBH EXPLOSIVSTOFF- UND SYSTEMTECHNIK (DE) 2021-07-08 US claimed
EP-3560913-A1 PROCESS FOR THE PRODUCTION OF TETRAZOLINONES Dynamit Nobel GmbH Explosivstoff- und Systemtechnik (DE) 2019-10-30 EP claimed
EP-0764642-B1 Process for the production of 1-Aryl-4-carbamoyl-tetrazolinones BAYER CROPSCIENCE AG (DE) 2002-12-04 EP claimed
US-5874586-A Process for preparing 1-aryl-4-carbamoyl-tetrazolinones BAYER AKTIENGESELLSCHAFT (DE) 1999-02-23 US claimed
EP-0764642-A2 Process for the production of 1-Aryl-4-carbamoyl-tetrazolinones BAYER AG (DE) 1997-03-26 EP claimed
JP-2545000-B2 FMC CORP (US) 1996-10-16 JP claimed
US-5407808-A Treating tumor with inhibitor of protoporphyrinogen conversion to heme FMC CORPORATION (US) 1995-04-18 US claimed
US-5298502-A Exposure to light in presence of oxidase inhibitor FMC CORPORATION (US) 1994-03-29 US claimed
EP-0447491-B1 PROTOPORPHYRINOGEN INHIBITORS AND THEIR USE IN COMPOSITIONS FOR DETECTING AND TREATING TUMOURS FMC CORP (US) 1993-08-11 EP claimed
EP-0447491-A1 Protoporphyrinogen inhibitors and their use in compositions for detecting and treating Tumours. FMC CORP (US) 1991-09-25 EP claimed
WO-1990006748-A2 USE OF CERTAIN HERBICIDES IN CANCER TREATMENT AND PRODUCTION OF PROTOPORPHYRIN IX FMC CORPORATION (US) 1990-06-28 WO claimed
JP-9124618-A None JP disclosed
US-20210206732-A1 Process for the Production of Tetrazolinones DYNAMIT NOBEL GMBH EXPLOSIVSTOFF- UND SYSTEMTECHNIK (DE) 2021-07-08 US disclosed
EP-3560913-A1 PROCESS FOR THE PRODUCTION OF TETRAZOLINONES Dynamit Nobel GmbH Explosivstoff- und Systemtechnik (DE) 2019-10-30 EP disclosed
EP-0764642-B1 Process for the production of 1-Aryl-4-carbamoyl-tetrazolinones BAYER CROPSCIENCE AG (DE) 2002-12-04 EP disclosed
WO-1987003873-A1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF FMC CORPORATION (US) 1987-07-02 WO disclosed
EP-0161304-A4 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF. FMC CORP (US) 1986-04-15 EP disclosed
EP-0161304-A1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF. FMC CORP (US) 1985-11-21 EP disclosed
WO-1985001939-A1 HERBICIDAL 1-ARYL-4-SUBSTITUTED-1,4-DIHYDRO-5H-TETRAZOL-5-ONES AND SULFUR ANALOGS THEREOF FMC CORPORATION (US) 1985-05-09 WO disclosed
US-4167574-A N-phenyl-N-(4-piperidinyl)amides JANSSEN PHARMACEUTICA, N.V. (BE) 1979-09-11 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-20210206732-A1 Process for the Production of Tetrazolinones ABL1, TBCA, TST SLC9A1 4328/4885PTGS1 3247/4885PTGS2 3218/4885

“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.