SCHEMBL18290259

SCHEMBL18290259

CN(C[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C)c1ccnc2cc(Cl)ccc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDE P14735 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CLK1 P49759 1/20 0.39
BRD4 O60885 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
CHKA P35790 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CCR5 P51681 1/20 0.36
SLC6A2 P23975 1/20 0.36

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
SCHEMBL18281279 0.88 CHKA (0.43) IDEMEN1KMT2ACLK1SMN1; SMN2
SCHEMBL18281277 0.88 CHKA (0.43) IDEMEN1KMT2ACLK1SMN1; SMN2
SCHEMBL6489302 0.78 HSD17B10 (0.41) IDEMEN1KMT2ACLK1BRD4
SCHEMBL6489308 0.78 HSD17B10 (0.41) IDEMEN1KMT2ACLK1BRD4
SCHEMBL2081892 0.74 SPHK1 (0.41) MEN1KMT2ABRD4
SCHEMBL2081890 0.74 SPHK1 (0.41) MEN1KMT2ABRD4
SCHEMBL8945093 0.72 FAAH (0.41) KMT2ABRD4ALDH1A1MAPT
SCHEMBL2080215 0.71 BRD4 (0.40) BRD4
SCHEMBL2080211 0.71 BRD4 (0.40) BRD4
SCHEMBL1833586 0.71 BRD4 (0.47) MEN1KMT2ABRD4ALDH1A1

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-2016196393-A2 AUTOPHAGY-INHIBITING COMPOUNDS AND USES THEREOF PRESAGE BIOSCIENCES, INC. (US) 2016-12-08 WO disclosed