SCHEMBL8698182

SCHEMBL8698182

CNCc1cccc([C]=O)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
PRMT6 Q96LA8 7/20 0.46
NOS1 P29475 1/20 0.45
EPHX2 P34913 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.42
HTR7 P34969 1/20 0.41
GLA P06280 1/20 0.39
ERCC1 P07992 1/20 0.38
ERCC4 Q92889 1/20 0.38
SCN8A Q9UQD0 1/20 0.38
CYP19A1 P11511 1/20 0.38
PARP1 P09874 1/20 0.38
VNN1 O95497 1/20 0.38
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL320058 0.82 LOXL2 (0.59) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL30471916 0.82 LOXL2 (0.59) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL19442370 0.81 KDM4E (0.47) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL8224396 0.79 KDM4E (0.55) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL1697126 0.79 MAPT (0.64) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL910601 0.78 MGLL (0.43) MAPTGLA
Hydrochloric Acid SCHEMBL3273205 0.77 MAPT (0.68) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL2324273 0.77 HIF1A (0.54) KDM4EMAPTMAOB
SCHEMBL6807724 0.76 CALM1 (0.50)
SCHEMBL7284285 0.75 LOXL2 (0.65) KDM4ECYP3A4MAPTNOS1EPHX2

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-0833845-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1998-04-08 EP disclosed
WO-1998008492-A1 TRANSDERMAL DELIVERY OF PEPTIDES NOVO NORDISK A/S (DK) 1998-03-05 WO disclosed
WO-1997000894-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-01-09 WO disclosed