SCHEMBL8925441

SCHEMBL8925441

CN1CCN(CC(O)[C]2C=CC=CN2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
KDM4E B2RXH2 2/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
MAOB P27338 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
MAPT P10636 2/20 0.34
RAB9A P51151 1/20 0.34
TSHR P16473 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL352281 0.69 GAA (1.00) GAAKDM4EALDH1A1KMT2AMEN1
SCHEMBL8924730 0.67 SLC6A2 (0.33)
SCHEMBL2066585 0.66 KDM4E (0.34) GAAKDM4EALDH1A1KMT2AMAPT
SCHEMBL18390096 0.66 GAA (0.59) GAAKDM4EGLAALDH1A1LMNA
SCHEMBL31341343 0.66 GAA (0.90) GAAKDM4EALDH1A1KMT2AMEN1
SCHEMBL11131278 0.64 KDM4E (0.58) GAAKDM4EGLAALDH1A1LMNA
SCHEMBL13181514 0.64 GAA (0.52) GAAKDM4EGLAPOLBALDH1A1
SCHEMBL18390275 0.64 GAA (0.60) GAAKDM4EGLAALDH1A1LMNA
SCHEMBL18390892 0.64 GAA (0.71) GAAKDM4EMAPTTSHR
SCHEMBL18390893 0.64 GAA (0.71) GAAKDM4EPOLBKMT2AMEN1

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-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed