SCHEMBL840024

SCHEMBL840024

O=C(O)[C@H]1NCC[C@H]1c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.52
MAOB P27338 6/20 0.51
MAOA P21397 4/20 0.51
KDM1A O60341 3/20 0.51
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
NR4A1 P22736 1/20 0.48
NR4A2 P43354 1/20 0.48
NR4A3 Q92570 1/20 0.48
S1PR5 Q9H228 1/20 0.47
MMP13 P45452 1/20 0.46
RAB9A P51151 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
PARP10 Q53GL7 1/20 0.46

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
SCHEMBL841064 1.00 KCNH2 (0.52) KCNH2MAOBMAOAKDM1AHTR2C
SCHEMBL310182 1.00 KCNH2 (0.52) KCNH2MAOBMAOAKDM1AHTR2C
SCHEMBL15964039 0.83 MEN1 (0.56) KCNH2MAOBNR4A1NR4A2NR4A3
Hydrochloric Acid SCHEMBL15955843 0.83 MEN1 (0.55) KCNH2MAOBNR4A1NR4A2NR4A3
SCHEMBL841243 0.81 MAOB (0.44) KCNH2MAOBMAOAKDM1AHTR2C
SCHEMBL311161 0.81 MAOB (0.44) KCNH2MAOBMAOAKDM1AHTR2C
SCHEMBL840905 0.81 MAOB (0.44) KCNH2MAOBMAOAKDM1AHTR2C
SCHEMBL350996 0.80 SLC1A2 (0.47)
SCHEMBL199461 0.80 SLC1A2 (0.47)
SCHEMBL199463 0.80 SLC1A2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934177-B1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LTD (GB) 2012-05-02 EP disclosed
US-8153681-B2 Method of treating epilepsy by administering 5-(4{[(2-fluorophenyl)methyl]oxy}phenyl)prolinamide Convergence Pharmaceuticals Limited (GB) 2012-04-10 US disclosed
US-8143306-B2 Methods of treating bipolar disorders Convergence Pharmaceuticals Limited (GB) 2012-03-27 US disclosed
US-20110098335-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2011-04-28 US disclosed
US-7855218-B2 (5R)-5-(4-{[(2-fluorophenyl)methyl]oxy}phenyl)-L-prolinamide; depression or a mood disorder ; modulation of use-dependent voltage-gated sodium channels Convergence Pharmaceuticals Limited (GB) 2010-12-21 US disclosed
EP-1943216-B1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LTD (GB) 2010-06-30 EP disclosed
US-20100105754-A1 5-(4PHENYL)PROLINAMIDE FOR TREATMENT OF EPILEPSY GLAXO GROUP LIMITED (GB) 2010-04-29 US disclosed
US-7655693-B2 Compounds GLAXO GROUP LIMITED (GB) 2010-02-02 US disclosed
US-20080306122-A1 Novel Compounds Convergence Pharmaceuticals Limited (GB) 2008-12-11 US disclosed
US-20080280969-A1 Novel Compounds GLAXO GROUP LIMITED 2008-11-13 US disclosed
EP-1943216-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2008-07-16 EP disclosed
EP-1934177-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2008-06-25 EP disclosed
WO-2007042239-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2007-04-19 WO disclosed
WO-2007042250-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2007-04-19 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 (4 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-20110098335-A1 NOVEL COMPOUNDS SCN1A, SCN1B, SCNN1B KCNH2 65/4885MAOB 1571/4885MAOA 2022/4885
US-20080306122-A1 Novel Compounds CYP11B1, CYP11B2, CYP46A1 KCNH2 3313/4885MAOB 1619/4885MAOA 3055/4885
US-20080280969-A1 Novel Compounds CYP11B2, CYP46A1, SLC10A1 KCNH2 1998/4885MAOB 1719/4885MAOA 2630/4885
US-20100105754-A1 5-(4PHENYL)PROLINAMIDE FOR TREATMENT OF EPILEPSY SCN5A, SCN1A, SCN7A KCNH2 58/4885MAOB 1767/4885MAOA 2098/4885

“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.