SCHEMBL4234752

SCHEMBL4234752

CN1CCN(C(=O)c2[c]nccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.47
HRH3 Q9Y5N1 1/20 0.47
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
HPGD P15428 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
TSHR P16473 1/20 0.44
GRM5 P41594 1/20 0.43
ALOX15 P16050 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RIPK1 Q13546 1/20 0.41

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
SCHEMBL22683907 0.87 GNE (0.42) L3MBTL1HPGDKMT2ANPC1SMN1; SMN2
SCHEMBL8823572 0.87 GNE (0.46) L3MBTL1HPGDTSHRNPC1
SCHEMBL15416006 0.83 SIGMAR1 (0.50) HRH4HRH3POLBL3MBTL1HPGD
SCHEMBL4351967 0.83 SMN1; SMN2 (0.47) POLBL3MBTL1HPGDKMT2ATSHR
SCHEMBL15416319 0.83 HPGD (0.44) L3MBTL1HPGDKMT2AGRM5NPC1
SCHEMBL16585464 0.80 CYP2C9 (0.37) L3MBTL1HPGDCYP1A2CYP2D6CYP2C19
SCHEMBL2186819 0.75 POLB (0.51) HRH4POLBL3MBTL1HPGDKMT2A
SCHEMBL22684032 0.73 SPR (0.32) L3MBTL1
SCHEMBL13779955 0.72 L3MBTL1 (0.83) HRH4HRH3POLBL3MBTL1NPC1
SCHEMBL4279049 0.71

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
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed
WO-2009106565-A1 AGONISTS OF GPR119 BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed