SCHEMBL6074494

SCHEMBL6074494

O=C1NC(=O)C(Cc2ccc(N3CCC4(CC3)OCCO4)cc2)N1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 12/20 0.43
ADAMTS4 O75173 2/20 0.41
LGMN Q99538 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADAM17 P78536 2/20 0.36
ADAM10 O14672 1/20 0.36
MMP12 P39900 1/20 0.36
ADAM9 Q13443 1/20 0.36
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
MMP2 P08253 1/20 0.34

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
SCHEMBL6074839 0.81 ADAMTS5 (0.47) ADAMTS5ADAMTS4L3MBTL3L3MBTL1ADAM17
SCHEMBL6074498 0.77 MAPT (0.51) LGMNALDH1A1MAPTHRH3
SCHEMBL6680323 0.71 LGMN (0.54) LGMNL3MBTL3L3MBTL1ALDH1A1KDM4E
SCHEMBL6074426 0.71 LGMN (0.50) LGMNL3MBTL3L3MBTL1ALDH1A1MAPT
SCHEMBL23387256 0.70 ITGB3 (0.56) LGMNL3MBTL3L3MBTL1ALDH1A1
SCHEMBL5546662 0.69 POLB (0.55) LGMNALDH1A1GAAKDM4EMAPT
SCHEMBL6704329 0.69 PPARG (0.44) ADAMTS5ADAMTS4ADAM17ADAM10MMP12
SCHEMBL4938700 0.68 HRH3 (0.56) LGMNL3MBTL3L3MBTL1ALDH1A1MAPT
SCHEMBL6073828 0.68 LGMN (0.47) LGMNL3MBTL3L3MBTL1ALDH1A1GAA
SCHEMBL6132758 0.68 LGMN (0.52) LGMNALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7022716-B2 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH (US) 2006-04-04 US disclosed
US-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2003-07-31 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-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 ADAMTS5 3757/4885ADAMTS4 4268/4885LGMN 4736/4885

“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.