SCHEMBL14640733

SCHEMBL14640733

CCC(=O)CN1c2ccccc2C2CCN(C(=O)OC(C)(C)C)CC21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
USP30 Q70CQ3 4/20 0.40
TACR1 P25103 1/20 0.40
STS P08842 1/20 0.39
IDO1 P14902 3/20 0.39

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
SCHEMBL13944382 0.88 KDM4E (0.43) GPR119JAK2JAK1KDM4EPKM
SCHEMBL6490546 0.75 GPR119 (0.48) GPR119JAK2JAK1KDM4EPKM
SCHEMBL16002483 0.75 GPR119 (0.47) GPR119JAK2JAK1KDM4EPKM
SCHEMBL14039529 0.72 GPR119 (0.53) GPR119JAK2JAK1KDM4EPKM
SCHEMBL2227245 0.70 GPR119 (0.47) GPR119JAK2JAK1KDM4EPKM
SCHEMBL7712465 0.70 GPR119 (0.56) GPR119JAK2JAK1KDM4EPKM
SCHEMBL3062560 0.69 GPR119 (0.48) GPR119JAK2JAK1KDM4EPKM
SCHEMBL29960446 0.69 GPR119 (0.48) GPR119JAK2JAK1KDM4EPKM
SCHEMBL29960667 0.69 TERT (0.48) GPR119JAK2JAK1KDM4EPKM
SCHEMBL2078377 0.69 GPR119 (0.50) GPR119JAK2JAK1KDM4EPKM

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-2007007072-A1 5-HTX MODULATORS BIO-MEDISINSK INNOVASJON AS (NO) 2007-01-18 WO disclosed