SCHEMBL8569646

SCHEMBL8569646

NC(=O)CC[C@H]1CNc2ccccc2C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.57
MTNR1B P49286 1/20 0.57
EGFR P00533 1/20 0.43
SRC P12931 1/20 0.43
EPHX2 P34913 1/20 0.42
GAA P10253 2/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
IDO1 P14902 1/20 0.34
KDM4E B2RXH2 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGAV P06756 1/20 0.33
ITGA2B P08514 1/20 0.33
ITGB5 P18084 1/20 0.33

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
SCHEMBL8569647 1.00 MTNR1A (0.57) MTNR1AMTNR1BEGFRSRCEPHX2
SCHEMBL10974953 0.85 MTNR1A (0.64) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL6654070 0.85 MTNR1A (0.59) MTNR1AMTNR1BEGFRSRCEPHX2
SCHEMBL8922456 0.80 MTNR1A (0.54) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL13305786 0.80 MTNR1A (0.52) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL5539883 0.80 MTNR1A (0.56) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL29073344 0.78 MTNR1A (0.56) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL7828970 0.77 MTNR1A (0.61) MTNR1AMTNR1BEGFREPHX2GAA
SCHEMBL30576519 0.76 MTNR1A (0.55) MTNR1AMTNR1BEPHX2GAAMAPT
SCHEMBL16353622 0.76 MTNR1A (0.59) MTNR1AMTNR1BEPHX2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed
EP-0702004-A2 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives CIBA-GEIGY AG (CH) 1996-03-20 EP disclosed