SCHEMBL4868816

SCHEMBL4868816

CCN(Cc1cc(Br)ccc1OCc1ccccc1)c1ccc(C(=O)O)nn1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 15/20 0.54
CYP1A2 P05177 1/20 0.54
CCR5 P51681 4/20 0.47
USP28 Q96RU2 1/20 0.44
USP25 Q9UHP3 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
SCHEMBL7803947 0.92 PTGER1 (0.48) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL8161439 0.91 PTGER1 (0.46) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL8168635 0.91 PTGER1 (0.48) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL9055421 0.90 PTGER1 (0.46) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL8167536 0.88 USP28 (0.46) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL8162300 0.87 PTGER1 (0.51) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL7662551 0.87 HPGD (0.42) PTGER1CYP1A2
SCHEMBL8154853 0.86 PTGER1 (0.46) PTGER1CYP1A2CCR5USP28USP25
SCHEMBL8167308 0.86 PTGER1 (0.54) PTGER1CYP1A2CCR5
SCHEMBL8167529 0.86 PTGER1 (0.45) PTGER1CYP1A2CCR5USP28USP25

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040102524-A1 Method of treatment ASTRAZENECA AB (SE) 2004-05-27 US claimed
EP-1370266-A1 METHOD OF TREATMENT AstraZeneca AB (SE) 2003-12-17 EP claimed
US-20030114459-A1 Therapeutic agents ASTRAZENECA AB (SE) 2003-06-19 US claimed
US-6537991-B1 Method of treating a peripheral neuropathic pain ASTRAZENECA AB (SE) 2003-03-25 US claimed
JP-2002537233-A 2002-11-05 JP claimed
WO-2002072098-A1 METHOD OF TREATMENT ASTRAZENECA AB (SE) 2002-09-19 WO claimed
CN-1085663-C Aromatic amino ethers as analgesic agents ZENECA LTD (GB) 2002-05-29 CN claimed
EP-1154773-A2 USE OF ANTAGONISTS OF PG-E FOR THE TREATMENT OF NEUROPATHIC PAIN AstraZeneca AB (SE) 2001-11-21 EP claimed
EP-0773930-B1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LTD (GB) 2000-10-11 EP claimed
WO-2000048446-A2 USE OF ANTAGONISTS OF PG-E FOR THE TREATMENT OF NEUROPATHIC PAIN ASTRAZENECA AB (SE) 2000-08-24 WO claimed
CN-1154106-A Aromatic amino ethers as analgesic agents ZENECA LTD (GB) 1997-07-09 CN claimed
EP-0773930-A1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LIMITED (GB) 1997-05-21 EP claimed
WO-1996003380-A1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LIMITED (GB) 1996-02-08 WO claimed
US-8076315-B2 In conjunction with serotonin receptor agonists, serotonin receptor antagonists, cannabinoid receptor agonists, serotonin reuptake inhibitors, noradrenalin reuptake inhibitors, endocannabinoid promoters, antagonists of cannabinoid membrane transporters, antagonists of cannabinoid degradative enzymes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-12-13 US disclosed
US-20080261922-A1 Pharmacological Treatments for Sleep Disorders (Apnoe) With Prostanoid Receptor Antagonists THE BOARD OF TRUSTEES OF THE UNIVERISTY OF ILLINOIS 2008-10-23 US disclosed
WO-2007047372-A2 PHARMACOLOGICAL TREATMENTS FOR SLEEP DISORDERS (APNOE) WITH PROSTANOID RECEPTOR ANTAGONISTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-04-26 WO disclosed
WO-2000048446-A2 USE OF ANTAGONISTS OF PG-E FOR THE TREATMENT OF NEUROPATHIC PAIN ASTRAZENECA AB (SE) 2000-08-24 WO disclosed
CN-1154106-A Aromatic amino ethers as analgesic agents ZENECA LTD (GB) 1997-07-09 CN disclosed
EP-0773930-A1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LIMITED (GB) 1997-05-21 EP disclosed
WO-1996003380-A1 AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS ZENECA LIMITED (GB) 1996-02-08 WO 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-20040102524-A1 Method of treatment PTGER1, PTGS1, PTGER2 PTGER1 1/4885CYP1A2 1298/4885CCR5 1461/4885

“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.