SCHEMBL8494183

SCHEMBL8494183

c1ccc(-c2ccc(N3CCc4ccccc4C3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EED O75530 2/20 0.64
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
NPC1 O15118 1/20 0.51
CYP1A2 P05177 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RAB9A P51151 1/20 0.51
GRIN2D O15399 3/20 0.49
GRIN3B O60391 3/20 0.49
GRIN1 Q05586 3/20 0.49
GRIN2A Q12879 3/20 0.49
GRIN2B Q13224 3/20 0.49
GRIN2C Q14957 3/20 0.49
GRIN3A Q8TCU5 3/20 0.49
GAA P10253 1/20 0.48
IP6K1 Q92551 1/20 0.48
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47

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
SCHEMBL2600447 0.88 EED (0.72) EEDMEN1KMT2ANPC1CYP1A2
Hydrochloric Acid SCHEMBL10535845 0.86 EED (0.70) EEDMEN1KMT2ANPC1CYP1A2
SCHEMBL27723823 0.86 EED (0.81) EEDMEN1KMT2ANPC1CYP1A2
SCHEMBL6380662 0.86 MEN1 (0.54) EEDMEN1KMT2ANPC1RAB9A
SCHEMBL10534867 0.81 MEN1 (0.75) EEDMEN1KMT2ANPC1MAPT
SCHEMBL10535865 0.81 EED (0.64) EEDMEN1KMT2ANPC1MAPT
SCHEMBL29375196 0.81 EED (0.64) EEDMEN1KMT2AMAPTGRIN2D
SCHEMBL702928 0.81 EED (0.64) EEDMEN1KMT2AMAPTGRIN2D
SCHEMBL10534823 0.81 EED (0.64) EEDMEN1KMT2AGRIN2DGRIN3B
SCHEMBL30101805 0.81 EED (0.64) EEDMEN1KMT2AGRIN2DGRIN3B

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
WO-1999024022-A2 ISOQUINOLINE DERIVATIVES FOR TREATING DISORDERS ASSOCIATED WITH 5HT7 RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 1999-05-20 WO disclosed