SCHEMBL6995339

SCHEMBL6995339

Oc1noc2cccnc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.43
MMP2 P08253 2/20 0.41
TSHR P16473 2/20 0.41
METAP2 P50579 2/20 0.41
METAP1 P53582 2/20 0.41
CHRM1 P11229 1/20 0.41
COMT P21964 1/20 0.41
ADRA1A P35348 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
KDM4E B2RXH2 9/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
MPI P34949 1/20 0.40
HSP90AA1 P07900 9/20 0.38
HTT P42858 6/20 0.38
LMNA P02545 5/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
TP53 P04637 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
MAPT P10636 3/20 0.38
ALOX15 P16050 3/20 0.38

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
SCHEMBL29813609 0.75 EPHX2 (0.43) EPHX2MMP2TSHRMETAP2METAP1
SCHEMBL4069524 0.75 HSP90AA1 (0.43) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL2395997 0.75 KDR (0.43) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL28673021 0.75 EPHX2 (0.43) EPHX2MMP2TSHRMETAP2METAP1
SCHEMBL4243185 0.73 KDM4E (0.47) EPHX2TSHRKDM4EL3MBTL1LMNA
SCHEMBL14048218 0.71 GRM4 (0.45) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL14030326 0.71 EPHX2 (0.43) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL21120773 0.71 EPHX2 (0.40) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL11914607 0.71 GRM4 (0.45) EPHX2MMP2TSHRKDM4EL3MBTL1
SCHEMBL18878950 0.71 EPHX2 (0.54) EPHX2MMP2TSHRKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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