SCHEMBL8427792

SCHEMBL8427792

CC(C)(C)OC(=O)N1CCC(CCCCCOC(=O)c2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.60
KDM4E B2RXH2 1/20 0.59
PKM P14618 1/20 0.59
TDP1 Q9NUW8 1/20 0.49
LIMK2 P53671 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
FAAH O00519 1/20 0.47
SCN1A P35498 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN3A Q9NY46 1/20 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
SCHEMBL8841108 0.95 KDM4E (0.61) GPR119KDM4EPKMTDP1MEN1
SCHEMBL18891231 0.91 KDM4E (0.64) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL4209884 0.85 KDM4E (0.65) GPR119KDM4EPKMLIMK2MEN1
SCHEMBL22983598 0.85 ACKR3 (0.51) GPR119KDM4EPKMSCN1ASCN2A
SCHEMBL28771668 0.85 ACKR3 (0.51) GPR119KDM4EPKMSCN1ASCN2A
SCHEMBL23006166 0.85 ACKR3 (0.51) GPR119KDM4EPKMSCN1ASCN2A
SCHEMBL389035 0.84 GPR119 (0.55) GPR119KDM4EPKMFAAH
SCHEMBL22633427 0.84 KDM4E (0.61) GPR119KDM4EPKMLIMK2MEN1
SCHEMBL21047201 0.81 KDM4E (0.61) GPR119KDM4EPKMMEN1KMT2A
SCHEMBL19859549 0.81 KDM4E (0.61) GPR119KDM4EPKMMEN1KMT2A

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
US-5973156-A Piperidine and tetrahydropyridine derivatives MERCK SHARP & DOME LTD. (GB) 1999-10-26 US disclosed