SCHEMBL10367683

SCHEMBL10367683

COC(=O)Oc1cc(-c2ccccc2)c(=O)n2c1-c1ccccc1CC2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.41
MTNR1B P49286 12/20 0.41
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA3 P34903 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL10367806 0.89 ALDH1A1 (0.38) GABRA1GABRG2GABRB3GABRA3KMT2A
SCHEMBL10368214 0.89 MAPT (0.39) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL10369721 0.84 KCNK3 (0.35) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL10367826 0.84 AVPR1A (0.37) GABRA1GABRG2GABRB3GABRA3KMT2A
SCHEMBL9338243 0.82 GABRG2 (0.53) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL10367418 0.79 GABRA1 (0.40) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL9334779 0.77 TSHR (0.40) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL7284938 0.77 MAPT (0.40) KMT2AKDM4EMAPTNPSR1ALDH1A1
SCHEMBL9682914 0.76 ALDH1A1 (0.40) MTNR1AMTNR1BGABRA1GABRG2GABRB3
SCHEMBL9338489 0.76 MAPK1 (0.46) MTNR1AMTNR1BGABRA1GABRG2GABRB3

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-0183994-B1 TRICYCLIC PYRIDONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1990-03-21 EP disclosed
EP-0183994-A1 Tricyclic pyridone derivatives F. HOFFMANN-LA ROCHE AG (CH) 1986-06-11 EP disclosed