SCHEMBL8031490

SCHEMBL8031490

CC(=O)NCCCc1ccc(O)c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.55
MTNR1B P49286 11/20 0.55
LMNA P02545 2/20 0.50
BLM P54132 2/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
PKM P14618 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
PTGS1 P23219 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL5988051 0.79 MTNR1A (0.56) MTNR1AMTNR1BL3MBTL1
SCHEMBL8030998 0.76 MTNR1A (0.67) MTNR1AMTNR1BL3MBTL1
SCHEMBL5988698 0.76 MTNR1A (0.56) MTNR1AMTNR1BL3MBTL1HSD17B10
SCHEMBL28219034 0.75 TYR (0.52) MEN1TSHRKMT2AKDM4EALDH1A1
SCHEMBL28233273 0.74 SMN1; SMN2 (0.57) MTNR1AMTNR1BL3MBTL1HPGD
SCHEMBL8526051 0.74 MEN1 (0.55) MTNR1AMTNR1BLMNABLMMEN1
SCHEMBL10110677 0.74 TYR (0.54) MEN1TSHRKMT2AKDM4EALDH1A1
SCHEMBL2543023 0.73 MTNR1A (0.52) MTNR1AMTNR1BL3MBTL1
SCHEMBL7721087 0.72 TYR (0.57) MEN1TSHRKMT2AKDM4EALDH1A1
SCHEMBL7569666 0.72 TYR (0.57) MEN1TSHRKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745586-B1 Aryl(alkyl) propylamides, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-03-08 EP claimed
US-5731352-A THERAPY FOR DISORDERS OF THE MELATONINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1998-03-24 US claimed
EP-0745586-A1 Aryl(alkyl) propylamides, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-12-04 EP claimed
EP-0745586-B1 Aryl(alkyl) propylamides, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-03-08 EP disclosed
US-5760071-A AN UREA OR THIOUREA COMPOUNDS FOR TREATING MELATONINERGIC SYSTEM DISORDER, SLEEP DISORDER ADIR ET COMPAGNIE (FR) 1998-06-02 US disclosed
US-5731352-A THERAPY FOR DISORDERS OF THE MELATONINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1998-03-24 US disclosed
EP-0745586-A1 Aryl(alkyl) propylamides, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-12-04 EP disclosed