SCHEMBL8477752

SCHEMBL8477752

CN(C)CCn1c(C(=O)NCCN2CCOCC2)c(C(c2ccc(O)cc2)c2ccc(O)cc2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 2/20 0.46
USP2 O75604 1/20 0.45
ALOX15 P16050 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 3/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
CD274 Q9NZQ7 1/20 0.42
HPGDS O60760 1/20 0.41
POLB P06746 1/20 0.41
PARP1 P09874 1/20 0.41
PTGER4 P35408 1/20 0.41

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
SCHEMBL8477583 0.95 ALDH1A1 (0.46) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8472581 0.93 KDM4E (0.46) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8472652 0.93 KDM4E (0.47) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8474602 0.92 KDM4E (0.49) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8476333 0.89 KDM4E (0.49) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8476267 0.88 EGFR (0.46) HPGDKDM4EALDH1A1HSD17B10LMNA
SCHEMBL8476897 0.88 ALDH1A1 (0.48) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8476854 0.88 PTGER4 (0.42) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8471992 0.87 KMT2A (0.47) HPGDKDM4EALDH1A1HSD17B10MAPK1
SCHEMBL8478305 0.86 KDM4E (0.51) HPGDKDM4EALDH1A1HSD17B10MAPK1

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-0782988-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed