SCHEMBL6993197

SCHEMBL6993197

Cc1ccc2onc(OCCN)c2n1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
KCNH2 Q12809 1/20 0.34
SCN5A Q14524 1/20 0.34
CCR1 P32246 1/20 0.33
RAB9A P51151 1/20 0.33
CCR5 P51681 1/20 0.33
CHEK1 O14757 1/20 0.33
TSHR P16473 1/20 0.32
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
PRKCH P24723 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCD Q05655 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL6994003 0.82 KCNH2 (0.39) FAAHMGLLKCNH2SCN5ACHEK1
SCHEMBL6990284 0.78 SLC6A4 (0.35) FAAHMGLLKCNH2SCN5A
SCHEMBL6990713 0.75 FAAH (0.40) FAAHMGLLKCNH2SCN5ACCR1
Hydrochloric Acid SCHEMBL6992034 0.75 IDO1 (0.35) FAAHMGLLCHEK1TSHRAPOBEC3A
Hydrochloric Acid SCHEMBL6992044 0.74 FAAH (0.39) FAAHMGLLKCNH2SCN5ARAB9A
SCHEMBL5617540 0.73 MAPT (0.44) FAAHMGLLRAB9AKDM4E
SCHEMBL6989173 0.73 FAAH (0.35) FAAHMGLLCHEK1PRKCHPRKCE
Hydrochloric Acid SCHEMBL6988527 0.72 FAAH (0.35) FAAHMGLLCHEK1KDM4E
SCHEMBL6996361 0.72 FAAH (0.35) FAAHMGLLCHEK1
SCHEMBL6986977 0.72 FAAH (0.35) FAAHMGLLCHEK1

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