SCHEMBL8284576

SCHEMBL8284576

O=C1c2ccc(-c3ccccc3)nc2CC2CCCCC12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
SRC P12931 1/20 0.36
S1PR1 P21453 1/20 0.35
CDC7 O00311 1/20 0.35
DBF4 Q9UBU7 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ADORA1 P30542 6/20 0.35
ADORA3 P0DMS8 4/20 0.35
ADORA2A P29274 4/20 0.35
GAA P10253 1/20 0.34
KMT2A Q03164 3/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 2/20 0.33
ADORA2B P29275 2/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4419478 0.82 KDM1A (0.41) HSD11B1
SCHEMBL4424046 0.77 MAPT (0.38) LMNATSHRMAPTHPGDGAA
SCHEMBL4419471 0.77 LMNA (0.33) LMNATSHR
SCHEMBL8283729 0.77 CHRNB2 (0.33) LMNATSHR
SCHEMBL4423418 0.76 GRM5 (0.55)
SCHEMBL4429832 0.75 RXFP1 (0.39) TSHRMAPTHPGDGAAKMT2A
SCHEMBL11643059 0.74 ALDH1A1 (0.39) ADORA1ADORA3ADORA2AKMT2ARAB9A
SCHEMBL4433329 0.73 PLK1 (0.39) LMNAGAA
SCHEMBL4421765 0.72 HSD11B1 (0.38) MAPTADORA1RAB9AALDH1A1SMN1; SMN2
SCHEMBL4419935 0.72 SMN1; SMN2 (0.42) LMNACDC7DBF4GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7598384-B2 Tetrahydroquinolinones and their use as antagonists of metabotropic glutamate receptors MERZ PHARMA GMBH & CO. KGAA (DE) 2009-10-06 US disclosed
EP-1723116-B1 TETRAHYDROQUINOLINONES AND THEIR USE AS ANTAGONISTS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO KGAA (DE) 2008-09-24 EP disclosed
WO-2005082856-A2 TETRAHYDROQUINOLINONES AND THEIR USE AS ANTAGONISTS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO. KGAA (DE) 2005-09-09 WO disclosed