SCHEMBL7699028

SCHEMBL7699028

CCCCCNc1nc(=O)[nH]c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 12/20 0.54
XDH P47989 3/20 0.50
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
BCHE P06276 1/20 0.43
TRPC3 Q13507 1/20 0.43
TRPC4 Q9UBN4 1/20 0.43
TRPC5 Q9UL62 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
SCHEMBL26985355 0.83 CA1 (0.49) GPR84XDHCA1CA2CA9
SCHEMBL4128821 0.78 XDH (0.56) GPR84XDHBCHETRPC3TRPC4
SCHEMBL7618338 0.72 XDH (0.55) GPR84XDHBCHETRPC3TRPC4
SCHEMBL10576480 0.72 XDH (0.45) GPR84XDHBCHETRPC3TRPC4
SCHEMBL9655166 0.70 GPR84 (0.58) GPR84XDH
SCHEMBL6685725 0.69 GPR84 (0.51) GPR84
SCHEMBL4384740 0.69 XDH (0.67) GPR84XDHBCHETRPC3TRPC4
SCHEMBL9288448 0.69 XDH (0.60) GPR84XDH
SCHEMBL9288451 0.69 XDH (0.47) GPR84XDHBCHETRPC3TRPC4
SCHEMBL20117490 0.68 GPR84 (0.56) GPR84XDHBCHETRPC3TRPC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005911-B1 ANALGESIC 6-ACYLAMINOTETRAHYDRO-1,3,5-TRIAZINE-2,4-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESS FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-02-17 EP claimed
US-4254122-A ANALGESICS, ANTIINFLAMMATORY AGENTS, ENZYME INHIBITORS OF PROSTAGLANDIN SYNTHETASE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-03-03 US claimed
EP-0005911-A1 Analgesic 6-acylaminotetrahydro-1,3,5-triazine-2,4-dione derivatives, pharmaceutical compositions thereof, and process for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-12-12 EP claimed
US-6335339-B1 PREVENTING HEPATITIS B INFECTION WITH VIRICIDE SCRIPTGEN PHARMACEUTICALS, INC. 2002-01-01 US disclosed
EP-1053230-A1 TRIAZINE ANTIVIRAL COMPOUNDS Scriptgen Pharmaceuticals, Inc. (US) 2000-11-22 EP disclosed
WO-1999036410-A9 TRIAZINE ANTIVIRAL COMPOUNDS SCRIPTGEN PHARM INC (US) 1999-09-30 WO disclosed
WO-1999036410-A1 TRIAZINE ANTIVIRAL COMPOUNDS SCRIPTGEN PHARMACEUTICALS, INC. (US) 1999-07-22 WO disclosed
EP-0005911-B1 ANALGESIC 6-ACYLAMINOTETRAHYDRO-1,3,5-TRIAZINE-2,4-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESS FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-02-17 EP disclosed
EP-0005911-B1 ANALGESIC 6-ACYLAMINOTETRAHYDRO-1,3,5-TRIAZINE-2,4-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND PROCESS FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-02-17 EP disclosed
US-4254122-A ANALGESICS, ANTIINFLAMMATORY AGENTS, ENZYME INHIBITORS OF PROSTAGLANDIN SYNTHETASE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-03-03 US disclosed
US-4254122-A ANALGESICS, ANTIINFLAMMATORY AGENTS, ENZYME INHIBITORS OF PROSTAGLANDIN SYNTHETASE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-03-03 US disclosed
EP-0005911-A1 Analgesic 6-acylaminotetrahydro-1,3,5-triazine-2,4-dione derivatives, pharmaceutical compositions thereof, and process for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-12-12 EP disclosed
EP-0005911-A1 Analgesic 6-acylaminotetrahydro-1,3,5-triazine-2,4-dione derivatives, pharmaceutical compositions thereof, and process for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-12-12 EP disclosed