SCHEMBL6959176

SCHEMBL6959176

CC(C)(C)OC(=O)ON1CCC(c2ccc(OC/C=C/COc3ccccc3)cc2)C(O)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.37
PDE4B Q07343 1/20 0.35
KDM1A O60341 3/20 0.34
RORC P51449 1/20 0.34
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
SSTR4 P31391 1/20 0.33
SLC18A3 Q16572 1/20 0.33
TACR1 P25103 1/20 0.33
YAP1 P46937 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
SCHEMBL6956098 1.00 MEN1 (0.39) MEN1KMT2AHTTPDE4BKDM1A
SCHEMBL6949915 0.93 KMT2A (0.41) MEN1KMT2AHTT
SCHEMBL7074937 0.91 MEN1 (0.41) MEN1KMT2AHTTPDE4BKDM1A
SCHEMBL6951315 0.90 PDE4B (0.41) MEN1KMT2AHTTPDE4B
SCHEMBL6954512 0.90 PDE4B (0.43) MEN1KMT2AHTTPDE4BKDM1A
SCHEMBL6959516 0.89 KMT2A (0.39) MEN1KMT2AHTTPDE4BKDM1A
SCHEMBL6959509 0.88 NPC1 (0.44) KDM1AMAOAMAOBYAP1
SCHEMBL6956320 0.88 MEN1 (0.40) MEN1KMT2AKDM1A
SCHEMBL6954704 0.87 MEN1 (0.41) MEN1KMT2AHTTKDM1AMAOA
SCHEMBL6956951 0.86 PPARA (0.40) MEN1KMT2AHTTPDE4BKDM1A

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
EP-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed
EP-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 WO disclosed