SCHEMBL6997384

SCHEMBL6997384

Cc1ccc2onc(OCCN)c2c1C#N

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL6987159 0.85 ALDH1A1 (0.34) FAAHMGLLALDH1A1MAPK1HSD17B10
SCHEMBL6988542 0.84 ALDH1A1 (0.31) ALDH1A1MAPK1HSD17B10
Hydrochloric Acid SCHEMBL6994791 0.84 ALDH1A1 (0.33) ALDH1A1MAPK1HSD17B10
SCHEMBL6989173 0.82 FAAH (0.35) FAAHMGLL
Hydrochloric Acid SCHEMBL6988527 0.81 FAAH (0.35) FAAHMGLL
SCHEMBL6996361 0.81 FAAH (0.35) FAAHMGLL
SCHEMBL8201516 0.80 FAAH (0.34) FAAHMGLL
Hydrochloric Acid SCHEMBL6989236 0.78 FAAH (0.33) FAAHMGLL
SCHEMBL6989241 0.78 FAAH (0.33) FAAHMGLL
SCHEMBL6989250 0.77 FAAH (0.33) FAAHMGLL

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