SCHEMBL129849

SCHEMBL129849

[CH2]CCCCC(=O)OCCCC

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.64
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
ALDH1A1 P00352 2/20 0.54
DNM1 Q05193 1/20 0.53
TSHR P16473 3/20 0.50
PAM P19021 2/20 0.48
NAAA Q02083 1/20 0.48
HTR2C P28335 1/20 0.47
HPGD P15428 1/20 0.47
MAPT P10636 1/20 0.46
ATM Q13315 2/20 0.45
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL129577 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8459151 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL7839213 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8453125 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL7839840 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL4740630 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL2485452 0.98 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL3064415 0.94 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL7332890 0.94 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL7509234 0.94 DGKA (0.68) DGKAPRSS1PRSS2PRSS3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4960768-A Acyloxythiophene-carboxamide fungicides BAYER AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
US-4863954-A Acyloxythiophene-carboxamide fungicides BAYER AKTIENGESELLSCHAFT (DE) 1989-09-05 US claimed
US-4767757-A Acyloxythiophene-carboxamide fungicides, compositions and use BAYER AKTIENGESELLSCHAFT (DE) 1988-08-30 US claimed
EP-0241735-A2 Acyloxythiophene carbon amide BAYER AG (DE) 1987-10-21 EP claimed
EP-1654582-B1 Siloxane-based film for a suspended-particle-device light valve and method of preparing the film RESEARCH FRONTIERS INC (US) 2014-11-19 EP disclosed
US-8450319-B2 Pyrrolopyridazinone compound UBE INDUSTRIES, LTD. (JP) 2013-05-28 US disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
EP-1982986-B1 PYRROLOPYRIDAZINONE COMPOUND AS PDE4 INHIBITOR UBE INDUSTRIES (JP) 2012-03-07 EP disclosed
CN-101374844-A Pyrrolopyridazinone compound UBE INDUSTRIES (JP) 2009-02-25 CN disclosed
US-20090036453-A1 Pyrrolopyridazinone Compound UBE INDUSTRIES, LTD. (JP) 2009-02-05 US disclosed
EP-1982986-A1 PYRROLOPYRIDAZINONE COMPOUND Ube Industries, Ltd. (JP) 2008-10-22 EP disclosed
EP-0241735-A2 Acyloxythiophene carbon amide BAYER AG (DE) 1987-10-21 EP disclosed
US-4478848-A Combating fungi with substituted anilinomethylene-oximes BAYER AKTIENGESELLSCHAFT (DE) 1984-10-23 US disclosed
EP-0072970-A1 Substituted anilinomethylene oximes, method for their preparation and their use as herbicides BAYER AG (DE) 1983-03-02 EP disclosed
US-4188403-A Cyclopentan-1-amines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-02-12 US disclosed
US-3993073-A Novel drug delivery device ALZA CORPORATION (US) 1976-11-23 US disclosed
US-3967618-A Drug delivery device ALZA CORPORATION (US) 1976-07-06 US disclosed
US-3948262-A Novel drug delivery device ALZA CORPORATION (US) 1976-04-06 US disclosed
US-3946089-A Block copolymer of polyamide and polyether, and its preparation and use TOYO BOSEKI KABUSHIKI KAISHA (JA) 1976-03-23 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-20090036453-A1 Pyrrolopyridazinone Compound CBR3, CBR1, CYC1 DGKA 3277/4885PRSS1 1706/4885PRSS2 4127/4885

“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.