SCHEMBL8476167

SCHEMBL8476167

O=C(NCCCN1CCCC1=O)c1c(C(c2ccccc2)c2ccccc2)c2ccccc2n1CCO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
KDM4E B2RXH2 3/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MAPK1 P28482 2/20 0.50
CREBBP Q92793 1/20 0.50
KMT2A Q03164 2/20 0.49
RAB9A P51151 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.47
USP2 O75604 1/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL8472040 0.92 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8474407 0.91 KDM4E (0.51) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8475303 0.91 KDM4E (0.48) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8472298 0.91 KDM4E (0.48) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8477086 0.90 KDM4E (0.49) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8474096 0.89 KDM4E (0.49) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL8476877 0.89 KDM4E (0.49) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8475823 0.89 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL8474623 0.88 KDM4E (0.48) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL8474664 0.88 KDM4E (0.46) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10

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 4 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
EP-0775114-A1 PROCESS FOR MAKING ANTIMICROBIAL COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1997-05-28 EP disclosed
WO-1996004247-A1 PROCESS FOR MAKING ANTIMICROBIAL COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1996-02-15 WO disclosed