SCHEMBL9534473

SCHEMBL9534473

O=C1CC(c2ccccc2O)=NN1c1cc(Cl)ccn1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 11/20 0.59
PDCD1 Q15116 9/20 0.59
MAOB P27338 7/20 0.51
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ESD P10768 1/20 0.39

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
SCHEMBL9536771 0.82 MAOB (0.61) CD274PDCD1MAOBMEN1MAPT
SCHEMBL9536506 0.81 CD274 (0.54) CD274PDCD1MAOB
SCHEMBL9533962 0.78 MAOB (0.62) CD274PDCD1MAOBMEN1LMNA
SCHEMBL9532880 0.78 MAOB (0.50) CD274PDCD1MAOB
SCHEMBL9533843 0.77 MAOB (0.49) CD274PDCD1MAOBMEN1KMT2A
SCHEMBL9534735 0.76 MAOB (0.63) CD274PDCD1MAOBMAPTKMT2A
SCHEMBL10381309 0.76 MAOB (0.60) CD274PDCD1MAOBMEN1LMNA
SCHEMBL10382659 0.74 MAOB (0.64) MAOBMEN1MAPTKMT2A
SCHEMBL22908687 0.74 CD274 (1.00) CD274PDCD1MEN1LMNAMAPT
SCHEMBL10381326 0.73 MAOB (0.60) CD274PDCD1MAOBMEN1LMNA

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-0539372-A1 THERAPEUTIC AGENTS The Boots Company PLC (GB) 1993-05-05 EP disclosed
WO-1991011448-A1 THERAPEUTIC AGENTS THE BOOTS COMPANY PLC (GB) 1991-08-08 WO disclosed