SCHEMBL697311

SCHEMBL697311

C[CH]OC(=O)CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
HPGD P15428 2/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.38
EPHX2 P34913 1/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36

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
SCHEMBL696376 0.98 L3MBTL1 (0.42) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL697748 0.94 L3MBTL1 (0.42) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL697320 0.90
SCHEMBL17223944 0.81 HPGD (0.41) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL1439007 0.81 ALDH1A1 (0.39) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL1996672 0.80 EPHX1 (0.41) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL1439288 0.79 L3MBTL1 (0.39) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL1438974 0.78 L3MBTL1 (0.40) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL607588 0.78 L3MBTL1 (0.39) EPHX1HPGDKMT2AL3MBTL1ALDH1A1
SCHEMBL1439754 0.77 L3MBTL1 (0.40) EPHX1HPGDKMT2AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6498159-B1 SUCH AS 4-((3-CHLORO-4-METHOXYBENZYL)AMINO)-1-((4-HYDROXY-4 -HYDROXYMETHYL)PIPERIDINO)-6-PHTHALAZINE CARBONITRILE EISAI CO., LTD. (JP) 2002-12-24 US claimed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US claimed
EP-0643059-A1 3-(3-Pyridinyl)-1H-indoles as thromboxane A2 synthetase inhibitors Pfizer Limited (GB) 1995-03-15 EP claimed
EP-0295100-B1 Methoxymethyl compounds ERBA CARLO SPA (IT) 1994-09-14 EP claimed
EP-0594588-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS Pfizer Limited (GB) 1994-05-04 EP claimed
EP-0358398-B1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS Pfizer Limited (GB) 1993-03-10 EP claimed
WO-1992014706-A1 CYCLOPENTANE-DERIVED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS PFIZER LIMITED (GB) 1992-09-03 WO claimed
US-5081116-A A 7-(2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido, 3-(1,3-dithiolan-2-yl)-3-cephem-4-carboxylic acid and ester derivatives YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-01-14 US claimed
WO-1991013054-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS PFIZER LIMITED (GB) 1991-09-05 WO claimed
EP-0392796-A2 Cephalosporin derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1990-10-17 EP claimed
US-4952577-A ANTIBIOTICS FARMITALIA CARLO ERBA S.R.L. (IT) 1990-08-28 US claimed
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP claimed
US-4874856-A ANTIBIOTICS BRISTOL-MYERS COMPANY (US) 1989-10-17 US claimed
EP-0304036-A2 3-(substituted)propenyl-7-(aminothiazolylacetamido)ceph-3-em-4-carboxylic acids and esters thereof Bristol-Myers Squibb Company (US) 1989-02-22 EP claimed
EP-0295100-A1 Methoxymethyl compounds FARMITALIA CARLO ERBA S.r.l. (IT) 1988-12-14 EP claimed
JP-3047187-A None JP disclosed
US-20130023504-A1 Modulation of Prostaglandin/Cyclooxygenase Metabolic Pathways HUNTER-FLEMING LIMITED (GB) 2013-01-24 US disclosed
EP-0304036-A2 3-(substituted)propenyl-7-(aminothiazolylacetamido)ceph-3-em-4-carboxylic acids and esters thereof Bristol-Myers Squibb Company (US) 1989-02-22 EP disclosed
EP-0304036-A2 3-(substituted)propenyl-7-(aminothiazolylacetamido)ceph-3-em-4-carboxylic acids and esters thereof Bristol-Myers Squibb Company (US) 1989-02-22 EP disclosed
US-4731361-A Alkeneamidocephalosporin esters SHIONOGI & CO., LTD. (JP) 1988-03-15 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-20130023504-A1 Modulation of Prostaglandin/Cyclooxygenase Metabolic Pathways PTGES2, PTGES, PTGS2 EPHX1 490/4885HPGD 22/4885KMT2A 3544/4885

“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.