SCHEMBL4430359

SCHEMBL4430359

CCCN1CCc2cc(C(=O)N3CCN4CCCCC4C3)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.48
WDR77 Q9BQA1 2/20 0.48
L3MBTL3 Q96JM7 7/20 0.47
L3MBTL1 Q9Y468 7/20 0.47
KDM2B Q8NHM5 2/20 0.45
CNR1 P21554 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
LRRK2 Q5S007 1/20 0.41
TP53 P04637 1/20 0.40
NAMPT P43490 1/20 0.40

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
SCHEMBL4438450 0.89 L3MBTL3 (0.50) L3MBTL3L3MBTL1KDM2BCNR1
SCHEMBL4430354 0.84 L3MBTL3 (0.56) L3MBTL3L3MBTL1KDM2BNAMPT
SCHEMBL4431692 0.83 L3MBTL3 (0.55) L3MBTL3L3MBTL1KDM2BNAMPT
SCHEMBL4529122 0.83 L3MBTL3 (0.51) L3MBTL3L3MBTL1KDM2BALDH1A1NAMPT
SCHEMBL4523703 0.82 L3MBTL3 (0.48) PRMT5WDR77L3MBTL3L3MBTL1KDM2B
SCHEMBL4530572 0.82 PDE4B (0.52) L3MBTL3L3MBTL1ALDH1A1KMT2ANAMPT
SCHEMBL4431810 0.82 L3MBTL3 (0.51) L3MBTL3L3MBTL1KDM2BMEN1ALDH1A1
SCHEMBL4519212 0.82 HPGD (0.55) KDM2BCNR1ALDH1A1HPGD
SCHEMBL4430623 0.81 ALDH1A1 (0.53) L3MBTL3L3MBTL1MEN1ALDH1A1HPGD
SCHEMBL1017674 0.80 KDM2B (0.44) PRMT5WDR77L3MBTL3L3MBTL1KDM2B

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
EP-2125741-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR Janssen Pharmaceutica, N.V. (BE) 2009-12-02 EP claimed
US-20090099158-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-16 US claimed
WO-2008109336-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 WO claimed
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

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.