SCHEMBL6259742

SCHEMBL6259742

CCN(Cc1ccccc1NCc1ccccc1)c1ccc(C(N)=O)nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 4/20 0.41
▸ IRAK4 Q9NWZ3 3/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ ENPP2 Q13822 1/20 0.40
▸ CD38 P28907 1/20 0.38
▸ RPS6KB1 P23443 4/20 0.37
▸ CDC7 O00311 1/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ CLK4 Q9HAZ1 1/20 0.37
▸ MKNK2 Q9HBH9 1/20 0.37
▸ VNN1 O95497 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ AKT1 P31749 1/20 0.36
▸ ASPH Q12797 1/20 0.35
▸ RIOX2 Q8IUF8 1/20 0.35

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
SCHEMBL6258918 0.91 ENPP2 (0.41) JAK3IRAK4JAK2JAK1TYK2
SCHEMBL6258056 0.81 ENPP2 (0.41) JAK3IRAK4JAK2JAK1TYK2
SCHEMBL7803947 0.73 PTGER1 (0.48) —
SCHEMBL6255830 0.71 ENPP2 (0.36) ENPP2KDM4E
SCHEMBL5681666 0.69 HSD17B10 (0.51) JAK3IRAK4JAK2JAK1TYK2
SCHEMBL5133216 0.68 NNMT (0.41) ENPP2KDM4E
SCHEMBL893345 0.67 HSD17B10 (0.60) KDM4EHDAC8HSD17B10BACE1
SCHEMBL6259172 0.67 SLC6A4 (0.47) ENPP2
SCHEMBL11637312 0.67 HCAR3 (0.46) ENPP2KDM4E
SCHEMBL11217423 0.66 HSD17B10 (0.55) KDM4ESCDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0752421-B1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ASTRAZENECA AB (SE) 2005-10-12 — — EP disclosed
US-6787562-B2 ANALGESICS; OSTEOPOROSIS ZENECA LTD. (GB) 2004-09-07 — — US disclosed
US-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists SYNGENTA LIMITED (GB) 2003-07-24 — — US disclosed
US-6057345-A ANTAGONISTS OF THE PAIN ENHANCING EFFECTS OF E-TYPE PROSTAGLANDINS; USED IN PAIN RELIEF ZENECA LIMITED (GB) 2000-05-02 — — US disclosed
US-5834468-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS, ANALGESICS TREATING RHEUMATIC DISEASE, BONE DISORDER, INJURIES ZENECA LIMITED (GB) 1998-11-10 — — US disclosed
EP-0752421-A1 Ortho-substituted aromatic compounds, containing three (het)aryl moieties, their preparation and their use as prostaglandin E2-(PGE2)-antagonists ZENECA LIMITED (GB) 1997-01-08 — — EP 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-20030139418-A1 Substituted aryl and heteroaryl compounds as E-type prostaglandin antagonists PTGER1, PTGDR, PTGER2 JAK3 3668/4885IRAK4 2471/4885JAK2 1491/4885

“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.

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