SCHEMBL7917245

SCHEMBL7917245

COc1cc(COc2cccc(Br)c2)cc(OC)c1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 16/20 0.77
APP P05067 1/20 0.55
MRGPRX4 Q96LA9 1/20 0.52
ABCB1 P08183 1/20 0.50
MAOA P21397 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
SCHEMBL16795652 0.90 MAOB (0.88) MAOBMRGPRX4MAOA
SCHEMBL16795550 0.87 MAOB (1.00) MAOBAPPMRGPRX4MAOA
SCHEMBL28075228 0.87 MAOB (0.75) MAOBAPP
SCHEMBL5987976 0.81 MAOB (0.76) MAOBAPPMRGPRX4ABCB1MAOA
SCHEMBL91264 0.81 MAOB (0.67) MAOBAPPMRGPRX4ABCB1
SCHEMBL7917111 0.81 MAOB (0.62) MAOBAPPMRGPRX4ABCB1
SCHEMBL29775530 0.81 MAOB (0.57) MAOBAPPMRGPRX4ABCB1
SCHEMBL4404036 0.80 MAOB (1.00) MAOBMRGPRX4MAOA
SCHEMBL13332739 0.80 MAOB (0.70) MAOBAPPMRGPRX4ABCB1
SCHEMBL8265677 0.80 MAOB (0.77) MAOBAPPMRGPRX4ABCB1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225352-B1 USEFUL AS AGENTS IN THE TREATMENT OF CANCER, ALZHEIMERS DISEASE, THROMBOSIS, INFLAMMATORY DISEASES, AND BACTERIAL RESISTANCE WARNER-LAMBERT COMPANY 2001-05-01 US disclosed
WO-1998006691-A2 LOW MOLECULAR WEIGHT DENDRITIC COMPOUNDS AS PHARMACEUTICAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-02-19 WO disclosed