SCHEMBL38666100

SCHEMBL38666100

Nc1c(Br)ncc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.47
GPR3 P46089 1/20 0.47
PDPK1 O15530 1/20 0.42
F12 P00748 1/20 0.41
PLAU P00749 1/20 0.41
NCF1 P14598 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
BACE1 P56817 1/20 0.41
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HSD17B10 Q99714 4/20 0.40
TDP1 Q9NUW8 4/20 0.40
GLA P06280 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40
MAOA P21397 2/20 0.40
CHRM2 P08172 1/20 0.40

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
SCHEMBL3293976 1.00 KDM4E (0.47) KDM4EGPR3PDPK1F12PLAU
SCHEMBL28301397 0.78 KDM4E (0.50) KDM4EGPR3PDPK1F12PLAU
SCHEMBL30901311 0.78 KDM4E (0.50) KDM4EGPR3PDPK1F12PLAU
SCHEMBL16552260 0.78 KDM4E (0.50) KDM4EGPR3PDPK1F12PLAU
SCHEMBL17942817 0.77 KDM4E (0.48) KDM4EGPR3PDPK1F12PLAU
SCHEMBL21956930 0.77 KDM4E (0.48) KDM4EGPR3PDPK1ALDH1A1SMN1; SMN2
SCHEMBL7435560 0.75 KDM4E (0.47) KDM4EGPR3PDPK1F12PLAU
SCHEMBL31636739 0.75 KDM4E (0.47) KDM4EGPR3SMN1; SMN2TDP1MAOA
SCHEMBL15401178 0.75 KDM4E (0.47) KDM4EGPR3PDPK1F12PLAU
SCHEMBL9589217 0.75 KDM4E (0.47) KDM4EGPR3SMN1; SMN2TDP1MAOA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026106389-A1 NMT INHIBITOR AND USE THEREOF 주식회사 이노보테라퓨틱스 2026-05-21 WO disclosed