SCHEMBL8000757

SCHEMBL8000757

CC(C)(C)OC(=O)N1CCC(CNC(=S)NC(=O)c2ccccc2)CC1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.80
PKM P14618 1/20 0.80
TGFBR1 P36897 1/20 0.50
ALDH1A1 P00352 1/20 0.48
GLA P06280 1/20 0.48
ALOX12 P18054 1/20 0.48
BRD4 O60885 1/20 0.48
GPR119 Q8TDV5 2/20 0.48
CCR8 P51685 1/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
STS P08842 1/20 0.47
TP53 P04637 1/20 0.47
KMT2A Q03164 1/20 0.47
NAMPT P43490 1/20 0.47
ACKR3 P25106 1/20 0.46
KDM1A O60341 1/20 0.46

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
SCHEMBL26131403 0.89 KDM4E (1.00) KDM4EPKMTGFBR1BRD4GPR119
SCHEMBL7993458 0.84 ALDH1A1 (0.56) KDM4EPKMALDH1A1GLAALOX12
SCHEMBL2584410 0.80 ALDH1A1 (0.65) KDM4EALDH1A1GLAALOX12KMT2A
SCHEMBL5879547 0.79 KDM4E (0.61) KDM4EPKMTGFBR1BRD4GPR119
SCHEMBL4514614 0.79 KDM4E (0.59) KDM4EPKMTGFBR1ALDH1A1KEAP1
SCHEMBL15661860 0.79 KDM4E (0.80) KDM4EPKMTGFBR1GPR119KMT2A
SCHEMBL13947430 0.79 KDM4E (0.80) KDM4EPKMGPR119TP53KMT2A
SCHEMBL3036555 0.79 KDM4E (0.80) KDM4EPKMTGFBR1GPR119KMT2A
SCHEMBL4508195 0.78 KDM4E (0.57) KDM4EPKMTGFBR1BRD4GPR119
SCHEMBL7090271 0.78 KDM4E (0.71) KDM4EPKMTGFBR1BRD4GPR119

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-2001064675-A1 CONDENSED THIAZOLAMINES AND THEIR USE AS NEUROPEPTIDE Y5 ANTAGONISTS NOVARTIS AG (CH) 2001-09-07 WO disclosed