SCHEMBL8476333

SCHEMBL8476333

CN(C)CCn1c(C(=O)NCCCN2CCOCC2)c(C(c2ccccc2)c2ccccc2)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 2/20 0.48
MAPK1 P28482 2/20 0.48
HSD17B10 Q99714 2/20 0.48
ALOX15 P16050 1/20 0.48
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 2/20 0.46
GAA P10253 1/20 0.44
PARP1 P09874 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TACR2 P21452 1/20 0.44
HTT P42858 1/20 0.44
HIF1A Q16665 1/20 0.44
MAPT P10636 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
SCHEMBL8472581 0.96 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8477583 0.94 ALDH1A1 (0.46) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8476897 0.94 ALDH1A1 (0.48) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8471992 0.93 KMT2A (0.47) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8472229 0.92 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8477279 0.91 LMNA (0.51) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8472213 0.89 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8476916 0.89 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8477752 0.89 HPGD (0.46) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL8475932 0.88 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2HPGDMAPK1

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
US-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed