SCHEMBL6991003

SCHEMBL6991003

NCCONC(=O)c1noc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 19/20 0.56
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL20189383 0.81 HIF1A (0.67) HIF1A
SCHEMBL6988531 0.76 HIF1A (0.44) HIF1ATP53SMN1; SMN2
SCHEMBL29580724 0.75 HIF1A (0.58) HIF1A
SCHEMBL2907438 0.75 HIF1A (0.58) HIF1A
SCHEMBL2305838 0.75 HIF1A (0.57) HIF1ASMN1; SMN2
SCHEMBL6989463 0.75 HIF1A (0.43) HIF1A
SCHEMBL6986448 0.75 HIF1A (0.43) HIF1ATP53SMN1; SMN2
SCHEMBL6995937 0.75 HIF1A (0.45) HIF1A
SCHEMBL29581395 0.74 HIF1A (0.67) HIF1A
SCHEMBL2309765 0.74 HIF1A (0.67) HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0779281-B1 ISOXAZOLES SANKYO CO (JP) 2003-10-29 EP claimed
EP-0779281-A1 ISOXAZOLES SANKYO COMPANY LIMITED (JP) 1997-06-18 EP claimed
EP-0779281-B1 ISOXAZOLES SANKYO CO (JP) 2003-10-29 EP disclosed
US-6096771-A ISOXAZOLE DERIVATIVES EXHIBITING EXCELLENT TYPE B AND TYPE A MONOAMINE OXIDASE INHIBITORY ACTIVITIES, THEREFORE USEFUL FOR PREVENTING PARKINSON'S DISEASE, DEPRESSION AND ALZHEIMER'S DISEASE SANKYO COMPANY, LIMITED (JP) 2000-08-01 US disclosed
US-5965591-A MONOAMINE OXIDASE INHIBITOR; FOR PROPHYLAXIS AND TREATING PARKINSON'S DISEASE, DEPRESSION AND ALZHEIMER'S DISEASE SANKYO COMPANY, LIMITED (JP) 1999-10-12 US disclosed
EP-0779281-A1 ISOXAZOLES SANKYO COMPANY LIMITED (JP) 1997-06-18 EP disclosed