SCHEMBL2820628

SCHEMBL2820628

CCCCNC(=O)c1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.54
HPGD P15428 2/20 0.53
DRD2 P14416 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
MLNR O43193 1/20 0.47
KDM2B Q8NHM5 2/20 0.46
CYP1A2 P05177 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NAMPT P43490 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL2822496 0.93 HRH3 (0.56) HRH3HPGDKDM2BNAMPTKMT2A
SCHEMBL1787705 0.88 HRH3 (0.61) HRH3KDM2B
SCHEMBL1788748 0.82 SMN1; SMN2 (0.56) HRH3SMN1; SMN2KMT2A
SCHEMBL1790897 0.82 HRH3 (0.76) HRH3KDM2BL3MBTL3L3MBTL1
SCHEMBL1788776 0.81 HRH3 (0.54) HRH3KDM2B
SCHEMBL1789796 0.81 HRH3 (0.54) HRH3HPGDKDM2BNAMPTKMT2A
SCHEMBL1791299 0.81 SMYD3 (0.59) HRH3HPGDSMN1; SMN2KDM2B
SCHEMBL1789719 0.81 HRH3 (0.53) HRH3HPGDKDM2BNAMPTKMT2A
SCHEMBL12608452 0.80 MAPT (0.53) HRH3KDM2BL3MBTL1
SCHEMBL1787748 0.80 SMYD3 (0.57) HRH3HPGDSMN1; SMN2KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007735-B1 2-SUBSTITUTED 4-BENZYLPHTHALAZINONE DERIVATIVES AS HISTAMINE H1 AND H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2010-10-27 EP disclosed
US-20090105225-A1 2-Substituted 4-Benzylphthalazinone Derivatives as Histamine H1 and H3 Antagonists GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20080039444-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-02-14 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 (2 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-20080039444-A1 COMPOUNDS CMA1, MRGPRX2, HRH2 HRH3 16/4885HPGD 118/4885DRD2 2461/4885
US-20090105225-A1 2-Substituted 4-Benzylphthalazinone Derivatives as Histamine H1 and H3 Antagonists HRH2, HRH3, HRH4 HRH3 2/4885HPGD 191/4885DRD2 992/4885

“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.