SCHEMBL10913041

SCHEMBL10913041

CN(C)CCOc1ccc2c(c1)C(=O)N(CCO)C2=O

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
ALDH1A1 P00352 3/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.53
HTT P42858 1/20 0.53
MAPK1 P28482 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TERT O14746 2/20 0.44
RAB9A P51151 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPT P10636 1/20 0.44
CHRNA7 P36544 1/20 0.44
POLB P06746 1/20 0.44
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43

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
SCHEMBL10909820 0.94 KDM4E (0.56) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10912256 0.88 KDM4E (0.51) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10911688 0.87 KMT2A (0.61) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10912619 0.86 KDM4E (0.52) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10910054 0.84 KDM4E (0.53) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10909601 0.82 CHRNB2 (0.46) KDM4EALDH1A1KMT2AMEN1HTT
Dimethylamine SCHEMBL10911945 0.82 KDM4E (0.53) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10911698 0.80 KDM4E (0.49) KDM4EALDH1A1KMT2AMEN1HTT
SCHEMBL10912048 0.80 POLB (0.46) KDM4EALDH1A1KMT2AMEN1HTT
Diethylamine SCHEMBL10910059 0.80 KDM4E (0.51) KDM4EALDH1A1KMT2AMEN1HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0171977-A1 Phthalimide derivatives, compositions containing them and a process for preparing them SANKYO COMPANY LIMITED (JP) 1986-02-19 EP claimed
EP-0171977-A1 Phthalimide derivatives, compositions containing them and a process for preparing them SANKYO COMPANY LIMITED (JP) 1986-02-19 EP disclosed