SCHEMBL8317855

SCHEMBL8317855

CCOC(=O)OC1C(C)CC(C)N1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
MEN1 O00255 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 2/20 0.33
GLA P06280 1/20 0.33
KDM4E B2RXH2 3/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
NLRP3 Q96P20 2/20 0.32
GAA P10253 1/20 0.32
AR P10275 2/20 0.31
HTT P42858 2/20 0.31
HSD17B10 Q99714 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CHRM1 P11229 1/20 0.31
SLC22A12 Q96S37 1/20 0.31

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
SCHEMBL8317102 0.89 KMT2A (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL8314373 0.88 MEN1 (0.32) KMT2AMEN1SMN1; SMN2ALDH1A1NLRP3
SCHEMBL8312985 0.83 ALDH1A1 (0.34) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL8316234 0.82 HSD11B1 (0.33) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL8316864 0.81 ALDH1A1 (0.38) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL8877115 0.81 KMT2A (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL8313464 0.81 NLRP3 (0.33) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL8316807 0.81 SMN1; SMN2 (0.37) KMT2AMEN1SMN1; SMN2MAPTKDM4E
SCHEMBL8317256 0.80 ALDH1A1 (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL8317229 0.79 KMT2A (0.38) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT

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
EP-0510068-B1 NEW CENTRALLY ACTING 6,7,8,9-TETRAHYDRO-3H-BENZ(e)INDOLE HETEROCYCLICS UPJOHN CO (US) 1999-04-14 EP disclosed