SCHEMBL11249366

SCHEMBL11249366

OCc1cn(-c2ccccc2)nc1-c1ccccc1

nearest known ligand 0.93

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.93
ALDH1A1 P00352 7/20 0.93
HSD17B10 Q99714 4/20 0.93
HPGD P15428 4/20 0.93
MAPT P10636 3/20 0.93
USP2 O75604 1/20 0.93
NPSR1 Q6W5P4 1/20 0.93
RAB9A P51151 6/20 0.80
NPC1 O15118 6/20 0.80
MEN1 O00255 5/20 0.80
KMT2A Q03164 5/20 0.80
GAA P10253 3/20 0.76
SMN1; SMN2 Q16637 3/20 0.74
HTT P42858 2/20 0.74
CA1 P00915 1/20 0.70
CA2 P00918 1/20 0.70
CA9 Q16790 1/20 0.70
MAPK1 P28482 2/20 0.68
TSHR P16473 1/20 0.68
LMNA P02545 1/20 0.63

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
SCHEMBL11247643 0.89 KDM4E (0.85) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL3407292 0.89 RAB9A (1.00) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11247655 0.89 KDM4E (0.75) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11247889 0.89 RAB9A (0.89) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11250829 0.89 ALDH1A1 (0.85) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11252112 0.89 RAB9A (1.00) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11252512 0.87 GAA (1.00) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11258152 0.85 RAB9A (0.73) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL11244031 0.85 RAB9A (1.00) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL17338375 0.85 KDM4E (0.73) KDM4EALDH1A1HSD17B10HPGDMAPT

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