SCHEMBL3393940

SCHEMBL3393940

O=C(N[C@H]1CCc2ccccc2C1)c1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.60
MTNR1B P49286 5/20 0.60
TAOK1 Q7L7X3 4/20 0.50
GRM5 P41594 1/20 0.50
TAOK3 Q9H2K8 4/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HTT P42858 1/20 0.46
CYP46A1 Q9Y6A2 1/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
ADORA2A P29274 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
SCHEMBL3393199 1.00 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3
SCHEMBL3393202 1.00 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3
SCHEMBL9731843 0.88 MTNR1A (0.67) MTNR1AMTNR1BTAOK1TAOK3NPC1
SCHEMBL3392060 0.83 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3
SCHEMBL30823644 0.83 MEN1 (0.68) MTNR1AMTNR1BTAOK1TAOK3NPC1
SCHEMBL22289338 0.83 MEN1 (0.68) MTNR1AMTNR1BTAOK1TAOK3NPC1
SCHEMBL5522805 0.83 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3
SCHEMBL3390898 0.83 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3
SCHEMBL1544549 0.78 L3MBTL1 (0.61) GRM5NPC1RAB9ASMN1; SMN2CYP46A1
SCHEMBL3394258 0.78 MTNR1A (0.60) MTNR1AMTNR1BTAOK1GRM5TAOK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370530-B1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL SANOFI AVENTIS DEUTSCHLAND (DE) 2010-12-29 EP disclosed
US-6949556-B2 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-09-27 US disclosed
EP-1370530-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL Aventis Pharma Deutschland GmbH (DE) 2003-12-17 EP disclosed
US-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2003-01-30 US disclosed
WO-2002064565-A1 ACYLATED 1,2,3,4-TETRAHYDRONAPHTHYL AMINES AND THEIR USE AS PHARMACEUTICAL AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-08-22 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-20030022935-A1 Acylated 1,2,3,4-tetrahydronaphthyl amines and their use as pharmaceutical agents VEGFA, EDNRA, NR1H2 MTNR1A 604/4885MTNR1B 448/4885TAOK1 4329/4885

“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.