SCHEMBL3157934

SCHEMBL3157934

CNC(=O)Oc1ccc2c(c1)C(CNCCC(=O)N1CCc3cc(OC)c(OC)cc3CC1)C2

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.44
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
KMT2A Q03164 2/20 0.42
MTNR1B P49286 3/20 0.39
MTNR1A P48039 2/20 0.39
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
Hydrochloric Acid SCHEMBL4251273 0.99 ACHE (0.43) ACHEDPP4DPP8KMT2AMTNR1B
SCHEMBL3157230 0.91 DPP4 (0.45) DPP4DPP8KMT2AMTNR1BMTNR1A
Hydrochloric Acid SCHEMBL4251374 0.90 DPP4 (0.44) DPP4DPP8KMT2AMTNR1BMTNR1A
SCHEMBL3150154 0.89 DPP4 (0.43) ACHEDPP4DPP8KMT2AMTNR1B
SCHEMBL3158931 0.88 KMT2A (0.45) DPP4DPP8KMT2AMTNR1BMTNR1A
Hydrochloric Acid SCHEMBL4251190 0.88 DPP4 (0.42) ACHEDPP4DPP8KMT2AMTNR1B
Hydrochloric Acid SCHEMBL4252740 0.87 KMT2A (0.44) DPP4DPP8KMT2AMTNR1BMTNR1A
SCHEMBL3149736 0.85 DPP4 (0.46) DPP4DPP8KMT2AMTNR1BMTNR1A
SCHEMBL3163056 0.85 DPP4 (0.45) DPP4DPP8KMT2AABCB1MAPT
SCHEMBL3155060 0.85 CHRM2 (0.47) ACHEKMT2AMTNR1BABCB1ABCC1

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-2036892-B1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2010-03-10 EP disclosed
WO-2009066041-A2 DERIVATIVES OF 1,2,4,5-TETRAHYDRO-3H-BENZAZEPINES, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2009-05-28 WO disclosed
EP-2036892-A1 1,2,4,5-tetrahydro-3H-benzazepine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2009-03-18 EP disclosed