SCHEMBL7525811

SCHEMBL7525811

O=C1c2ccccc2C(=O)N1CCCOc1cccc2c1OCCO2

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.58
MTNR1A P48039 4/20 0.52
RAB9A P51151 3/20 0.51
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HPGD P15428 2/20 0.48
TSHR P16473 2/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 3/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
KMT2A Q03164 1/20 0.45
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SLC6A4 P31645 1/20 0.44

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
SCHEMBL7528940 0.96 HTR1A (0.60) HTR1AMTNR1ARAB9AMAPTSMN1; SMN2
SCHEMBL7339688 0.80 RAB9A (0.60) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL8584312 0.75 MTNR1A (0.60) HTR1AMTNR1ASLC6A4
SCHEMBL28484062 0.74 NPC1 (0.48) RAB9AMAPTSMN1; SMN2HPGDTSHR
SCHEMBL15064363 0.74 HTR1A (0.96) HTR1A
SCHEMBL15064317 0.74 HTR1A (1.00) HTR1A
SCHEMBL6597071 0.74 MTNR1A (0.59) HTR1AMTNR1ASLC6A4
SCHEMBL6173819 0.74 MTNR1A (0.59) HTR1AMTNR1ASLC6A4
SCHEMBL13534264 0.74 MTNR1A (0.64) HTR1AMTNR1AMAPTSLC6A4
SCHEMBL3447188 0.73 RAB9A (0.56) RAB9AMAPTSMN1; SMN2HPGDTSHR

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
EP-0873993-B1 Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-02-20 EP disclosed
EP-0873993-A1 Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-10-28 EP disclosed