SCHEMBL8563909

SCHEMBL8563909

CC(C)(C)[Si](C)(C)OC[C@@H]1Cc2ccccc2N(Cc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.53
MTNR1B P49286 4/20 0.53
TEAD1 P28347 2/20 0.40
BRS3 P32247 1/20 0.39
CACNA1G O43497 2/20 0.38
CACNA1H O95180 2/20 0.38
CACNA1I Q9P0X4 1/20 0.38
BRD4 O60885 3/20 0.37
SIRT1 Q96EB6 2/20 0.37
SIRT2 Q8IXJ6 1/20 0.36
ALOX12 P18054 1/20 0.36
NISCH Q9Y2I1 1/20 0.35
TOP2A P11388 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL8563914 1.00 MTNR1A (0.53) MTNR1AMTNR1BTEAD1BRS3CACNA1G
SCHEMBL9383824 0.83 TSHR (0.48) TOP2AGLAHPGD
SCHEMBL8563680 0.81 MTNR1A (0.60) MTNR1AMTNR1BBRS3CACNA1GCACNA1H
SCHEMBL8563681 0.81 MTNR1A (0.60) MTNR1AMTNR1BBRS3CACNA1GCACNA1H
SCHEMBL8563686 0.81 MTNR1A (0.60) MTNR1AMTNR1BBRS3CACNA1GCACNA1H
SCHEMBL15530736 0.79 MTNR1A (0.33) MTNR1AMTNR1BCACNA1GCACNA1HCACNA1I
SCHEMBL15534628 0.79 BRD4 (0.36) MTNR1AMTNR1BTEAD1CACNA1GCACNA1H
SCHEMBL28666165 0.77 HPGD (0.40) HPGD
SCHEMBL28666162 0.77 HPGD (0.40) HPGD
SCHEMBL10689632 0.76 MTNR1A (0.62) MTNR1AMTNR1BBRS3CACNA1GCACNA1H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719141-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-02-17 US disclosed