SCHEMBL6587892

SCHEMBL6587892

COc1cc2c(C3C(=O)Nc4cc(Br)ccc43)ncnc2cc1OCCCN1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.60
SRC P12931 14/20 0.53
KDR P35968 7/20 0.53
EGFR P00533 4/20 0.51
KDM1A O60341 1/20 0.50

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
Hydrochloric Acid SCHEMBL4508490 0.99 CHEK1 (0.59) CHEK1SRCKDREGFRKDM1A
SCHEMBL7205355 0.94 CHEK1 (0.54) CHEK1SRCKDREGFRKDM1A
Hydrochloric Acid SCHEMBL7211125 0.93 CHEK1 (0.54) CHEK1SRCKDREGFRKDM1A
SCHEMBL4506578 0.91 CHEK1 (0.60) CHEK1SRCKDREGFRKDM1A
Hydrochloric Acid SCHEMBL7205696 0.90 CHEK1 (0.59) CHEK1SRCKDREGFRKDM1A
SCHEMBL7205019 0.90 CHEK1 (0.58) CHEK1SRCKDREGFRKDM1A
SCHEMBL7211414 0.90 CHEK1 (0.58) CHEK1SRCKDREGFRKDM1A
Hydrochloric Acid SCHEMBL7211395 0.89 CHEK1 (0.57) CHEK1SRCKDREGFRKDM1A
SCHEMBL7209528 0.89 CHEK1 (0.58) CHEK1SRCKDREGFRKDM1A
SCHEMBL4519142 0.89 CHEK1 (0.77) CHEK1SRCKDREGFRKDM1A

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-1458394-A1 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 AstraZeneca AB (SE) 2004-09-22 EP claimed
WO-2003055492-A1 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER'S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 ASTRAZENECA AB (SE) 2003-07-10 WO claimed
EP-1458394-A1 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 AstraZeneca AB (SE) 2004-09-22 EP disclosed
WO-2003055492-A1 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER'S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 ASTRAZENECA AB (SE) 2003-07-10 WO disclosed