SCHEMBL4152600

SCHEMBL4152600

COc1ccc(-c2ccc3c(c2)CCC(N2CCCC2C)C3)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 12/20 0.40
PDE4A P27815 11/20 0.40
PDE4C Q08493 11/20 0.40
PDE4D Q08499 11/20 0.40
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL4152825 0.91 L3MBTL1 (0.38) ALDH1A1TSHR
SCHEMBL4145313 0.91 CRHBP (0.44) GAAALDH1A1
SCHEMBL4139873 0.90 NAAA (0.46) ALDH1A1MAPK1
SCHEMBL4128728 0.87 OPRM1 (0.40) ALDH1A1
SCHEMBL4128730 0.87 OPRM1 (0.40) ALDH1A1
SCHEMBL4143136 0.87 OPRM1 (0.40) ALDH1A1
SCHEMBL4128725 0.87 OPRM1 (0.40) ALDH1A1
SCHEMBL4143141 0.87 OPRM1 (0.40) ALDH1A1
SCHEMBL4142012 0.86 PDK1 (0.43) ALDH1A1TSHR
SCHEMBL4132423 0.86 SIGMAR1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed
EP-2007749-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR Pfizer Products Inc. (US) 2008-12-31 EP claimed
WO-2007105053-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-09-20 WO claimed
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 PDE4B 1236/4885PDE4A 1382/4885PDE4C 1519/4885

“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.