SCHEMBL8409084

SCHEMBL8409084

CC(=O)NC1Cc2cccc3[nH]cc(c23)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.62
MTNR1B P49286 4/20 0.62
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
CYP3A4 P08684 3/20 0.42
LMNA P02545 2/20 0.42
CYP2D6 P10635 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 2/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TSHR P16473 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
DRD2 P14416 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
DRD1 P21728 1/20 0.42

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
SCHEMBL10817102 0.82 MTNR1A (0.44) MTNR1AMTNR1BMEN1KMT2ACYP3A4
SCHEMBL23261872 0.80 MEN1 (0.45) MTNR1AMTNR1BMEN1KMT2ACYP3A4
SCHEMBL6075588 0.80 MTNR1A (0.72) MTNR1AMTNR1BHTR1ACA1CA2
SCHEMBL6077100 0.79 MTNR1A (0.70) MTNR1AMTNR1BHTR1ACA1CA2
SCHEMBL6075567 0.79 MTNR1A (0.70) MTNR1AMTNR1BHTR1ACA1CA2
SCHEMBL6076480 0.79 MTNR1A (0.70) MTNR1AMTNR1BHTR1ACA1CA2
SCHEMBL8406961 0.79 MTNR1A (0.57) MTNR1AMTNR1BCA1CA2CA12
SCHEMBL8409830 0.78 MTNR1A (0.69) MTNR1AMTNR1BHTR1ACA1CA2
SCHEMBL8409987 0.77 MTNR1A (1.00) MTNR1AMTNR1B
SCHEMBL10992208 0.77 DRD2 (0.42) MEN1KMT2ACYP3A4LMNACYP2D6

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-0737670-B1 Tricyclic amides, processes for their preparation, and pharmaceutical compositions containing them ADIR (FR) 1999-07-21 EP disclosed
EP-0737670-A1 Tricyclic amides, processes for their preparation, and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-10-16 EP disclosed