SCHEMBL6161213

SCHEMBL6161213

CC1CCCCN1C(=O)Oc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
GAA P10253 2/20 0.57
MAPK1 P28482 2/20 0.56
KDM4E B2RXH2 1/20 0.56
CHRNA7 P36544 1/20 0.55
HTR3A P46098 1/20 0.55
HPGD P15428 3/20 0.54
NPSR1 Q6W5P4 2/20 0.51
POLB P06746 1/20 0.51
HTT P42858 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
PABPC1 P11940 1/20 0.48

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
SCHEMBL3669791 0.96 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL5697246 0.95 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL5792711 0.84 KDM4E (0.50) ALDH1A1SMN1; SMN2GAAKDM4ECHRNA7
SCHEMBL22290361 0.84 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2HPGDNPSR1POLB
SCHEMBL11564055 0.82 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL30153751 0.81 CHRNB1 (0.47) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL27680432 0.81 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL830088 0.80 KMT2A (0.52) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL15085744 0.80 GAA (0.58) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E
SCHEMBL28617751 0.79 SMN1; SMN2 (0.72) ALDH1A1SMN1; SMN2GAAMAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110709391-A Modulators of indoleamine2, 3-dioxygenase 葛兰素史克知识产权开发有限公司 2020-01-17 CN disclosed
EP-1499589-A1 DERIVATIVES OF N-PHENYL(PIPERIDIN-2-YL)METHYL BENZAMIDE, THE PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2005-01-26 EP disclosed
WO-2004013100-A2 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-02-12 WO disclosed
WO-2003089411-A1 DERIVATIVES OF N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE, THE PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2003-10-30 WO disclosed