SCHEMBL20195236

SCHEMBL20195236

CCn1c(=O)cc(N2CCOCC2)c2cc(N3C(c4ccc(Cl)cc4)=CNC3O)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 2/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
S1PR1 P21453 1/20 0.35
TSHR P16473 1/20 0.35
PRKDC P78527 6/20 0.34
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL20183663 0.78 TSHR (0.41) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL23253833 0.77 S1PR1 (0.34) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL20183818 0.75 BRD4 (0.37) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL20183776 0.73 KMT2A (0.61) KDM4EHPGDSMN1; SMN2MAPTMEN1
SCHEMBL20183547 0.70 GAA (0.47) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL20354266 0.70 PRKDC (0.54) KDM4EHPGDNPSR1GAASMN1; SMN2
SCHEMBL20183733 0.70 HIF1A (0.41) KDM4EHPGDNPSR1GAASMN1; SMN2
SCHEMBL20806222 0.70 GAA (0.40) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL20195167 0.70 PIK3C3 (0.41) METAP2KDM4EHPGDNPSR1GAA
SCHEMBL23254019 0.70 GAA (0.36) KDM4EHPGDNPSR1GAASMN1; SMN2

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
EP-3327004-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORP (JP) 2020-11-04 EP disclosed
EP-3327004-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP disclosed