SCHEMBL4519873

SCHEMBL4519873

CN(C)c1ccc(C(=O)N2CCc3cc(C(=O)N4CCN(C5CCC5)CC4)ccc3C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.50
WDR77 Q9BQA1 4/20 0.50
L3MBTL3 Q96JM7 5/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
NAMPT P43490 2/20 0.48
HRH3 Q9Y5N1 3/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
KDM4E B2RXH2 2/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL4518664 0.91 HSD11B1 (0.49) L3MBTL3L3MBTL1NAMPTKDM4EPOLB
SCHEMBL4430323 0.88 L3MBTL3 (0.52) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4520495 0.87 L3MBTL3 (0.53) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4437349 0.87 KDM4E (0.60) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4430632 0.86 L3MBTL3 (0.55) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4437246 0.86 NAMPT (0.61) L3MBTL3L3MBTL1NAMPTHRH3HPGD
SCHEMBL4529909 0.86 HRH3 (0.62) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4514585 0.86 L3MBTL3 (0.51) L3MBTL3L3MBTL1NAMPTHRH3KDM4E
SCHEMBL4439281 0.85 PDE4B (0.58) PRMT5WDR77L3MBTL3L3MBTL1HRH3
SCHEMBL4524503 0.85 MEN1 (0.52) L3MBTL3L3MBTL1NAMPTHRH3HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-16 US claimed
EP-2125741-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR Janssen Pharmaceutica, N.V. (BE) 2009-12-02 EP disclosed
US-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-16 US disclosed
US-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-16 US disclosed
US-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-16 US disclosed
WO-2008109336-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 WO disclosed
WO-2008109336-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 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-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH1 PRMT5 482/4885WDR77 592/4885L3MBTL3 2511/4885

“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.