SCHEMBL5341369

SCHEMBL5341369

O=C(Cc1ccccc1)NCCC1CCOc2cc(Br)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
HPGD P15428 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR1A P08908 1/20 0.40
KCNH2 Q12809 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.39

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
SCHEMBL5341367 0.92 MTNR1A (0.45) KDM4CL3MBTL1CNR1CNR2BCHE
SCHEMBL5346158 0.88 MTNR1A (0.44) HPGDNPC1RAB9AMTNR1AMTNR1B
SCHEMBL5337505 0.87 SIGMAR1 (0.44) HPGDNPC1RAB9AMTNR1AMTNR1B
SCHEMBL5227718 0.85 HTR1A (0.59) NPC1MTNR1AMTNR1BHTR1A
SCHEMBL6077449 0.82 SMN1; SMN2 (0.43) KDM4CHPGDNPC1RAB9AMTNR1A
SCHEMBL5346153 0.82 MTNR1A (0.47) CNR1HPGDNPC1RAB9AMTNR1A
SCHEMBL6075934 0.81 CA1 (0.39) KDM4CHPGDNPC1RAB9AMTNR1A
SCHEMBL5337503 0.81 MTNR1A (0.45) CNR1HPGDNPC1RAB9AMTNR1A
SCHEMBL5227713 0.78 HTR1A (0.59) NPC1MTNR1AMTNR1BALDH1A1HTR1A
SCHEMBL5419149 0.77 KDM4E (0.50) ACHEHPGDNPC1RAB9AMTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183318-B2 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2007-02-27 US disclosed
US-7126012-B2 Substituted cyclic compounds LES LABORATOIRES SERVIER (FR) 2006-10-24 US disclosed
US-7115752-B2 Substituted cyclic compounds LES LABORATOIRES SERVIER (FR) 2006-10-03 US disclosed
US-20050124682-A1 Substituted cyclic compounds LESIEUR DANIEL (FR) 2005-06-09 US disclosed
US-6872851-B1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LES LABORATORIES SERVIER (FR) 2005-03-29 US disclosed
US-20050059729-A1 Substituted cyclic compounds LESIEUR DANIEL (FR) 2005-03-17 US disclosed
US-20040002490-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LESIEUR DANIEL (FR) 2004-01-01 US disclosed
US-20040002491-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LESIEUR DANIEL (FR) 2004-01-01 US disclosed
US-6605632-B1 Affinity for melatonin receptors LES LABORATOIRES SERVIER (FR) 2003-08-12 US disclosed
EP-1077927-A1 NOVEL SUBSTITUTED CYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 2001-02-28 EP disclosed
WO-1999058495-A1 NOVEL SUBSTITUTED CYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1999-11-18 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-20050059729-A1 Substituted cyclic compounds CCNY, CCNT2, TECR KDM4C 1100/4885L3MBTL1 2712/4885CNR1 41/4885
US-20040002491-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them CYP4B1, CYP3A5, MC2R KDM4C 1834/4885L3MBTL1 4849/4885CNR1 31/4885
US-20050124682-A1 Substituted cyclic compounds CCNY, CCNT2, TECR KDM4C 1100/4885L3MBTL1 2712/4885CNR1 41/4885
US-20040002490-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them CYP3A5, CYP4B1, MC2R KDM4C 1814/4885L3MBTL1 4848/4885CNR1 33/4885

“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.