SCHEMBL11247643

SCHEMBL11247643

OCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.85
ALDH1A1 P00352 3/20 0.85
HPGD P15428 3/20 0.85
HSD17B10 Q99714 3/20 0.85
USP2 O75604 1/20 0.85
MAPT P10636 1/20 0.85
NPSR1 Q6W5P4 1/20 0.85
RAB9A P51151 4/20 0.74
KMT2A Q03164 4/20 0.74
MEN1 O00255 3/20 0.74
NPC1 O15118 3/20 0.74
DRD2 P14416 1/20 0.73
HTT P42858 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
PTGES O14684 4/20 0.68
CCNE1 P24864 6/20 0.67
CDK2 P24941 6/20 0.67
ALOX5 P09917 3/20 0.64
GAA P10253 2/20 0.63
LMNA P02545 1/20 0.60

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
SCHEMBL11247655 0.94 KDM4E (0.75) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL10508841 0.92 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL11249366 0.89 KDM4E (0.93) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL17338375 0.87 KDM4E (0.73) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL11255223 0.87 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL11250829 0.85 ALDH1A1 (0.85) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL3407292 0.85 RAB9A (1.00) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL11252112 0.85 RAB9A (1.00) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL29527718 0.85 KDM4E (0.69) KDM4EALDH1A1HPGDHSD17B10USP2
Lonazolac SCHEMBL25221 0.85 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10USP2

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-4325962-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIDYRETICS BYK-GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-04-20 US disclosed
US-4146721-A ANALGESICS, ANTIINFLAMMATORY AGENTS AND ANTIPYRETICS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1979-03-27 US disclosed