SCHEMBL8475823

SCHEMBL8475823

O=C(NCCCN1CCCC1=O)c1c(C(c2ccccc2)c2ccccc2)c2ccccc2n1CCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 3/20 0.49
MAPK1 P28482 2/20 0.49
CREBBP Q92793 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 2/20 0.45
RAB9A P51151 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
USP2 O75604 1/20 0.43
MEN1 O00255 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL8476167 0.89 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8472040 0.88 SMN1; SMN2 (0.50) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8474407 0.87 KDM4E (0.51) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8472298 0.87 KDM4E (0.48) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8475303 0.87 KDM4E (0.48) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8477086 0.86 KDM4E (0.49) ALDH1A1KDM4EHPGDHSD17B10MAPK1
Hydrochloric Acid SCHEMBL8474664 0.85 KDM4E (0.46) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8474096 0.85 KDM4E (0.49) ALDH1A1KDM4EHPGDHSD17B10MAPK1
Hydrochloric Acid SCHEMBL8476877 0.85 KDM4E (0.49) ALDH1A1KDM4EHPGDHSD17B10MAPK1
SCHEMBL8474623 0.85 KDM4E (0.48) ALDH1A1KDM4EHPGDHSD17B10MAPK1

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