SCHEMBL7280823

SCHEMBL7280823

O=C1CCCc2cccc(OCc3ccccc3)c21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.53
MAOB P27338 3/20 0.53
BRD4 O60885 2/20 0.53
RXRB P28702 5/20 0.51
RXRA P19793 4/20 0.51
RXRG P48443 3/20 0.51
MRGPRX4 Q96LA9 2/20 0.49
HPD P32754 6/20 0.47
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL16844582 0.91 MAPT (0.49) MAOAMAOBBRD4RXRBRXRA
SCHEMBL34466352 0.84 L3MBTL1 (0.45) MAOAMAOBBRD4RXRBRXRA
SCHEMBL29473827 0.83 MAPT (0.50) MAOBBRD4RXRBRXRARXRG
SCHEMBL16388131 0.83 MAPT (0.50) MAOBBRD4RXRBRXRARXRG
SCHEMBL12634774 0.79 ABCB1 (0.44) MAOAMAOBBRD4MAPTMAPK1
SCHEMBL7336863 0.79 MAOB (0.56) MAOAMAOBBRD4HPD
SCHEMBL16397981 0.78 RXRB (0.72) MAOAMAOBBRD4RXRBRXRA
SCHEMBL10585250 0.78 MAOA (0.49) MAOAMAOBBRD4RXRBRXRA
SCHEMBL29320880 0.78 ABCB1 (0.44) MAOAMAOBBRD4RXRBRXRA
SCHEMBL24459314 0.77 MAOA (0.51) MAOAMAOBBRD4HPDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239761-A1 BICYCLIC PHENOL COMPOUNDS AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2024-07-18 US disclosed
US-20240239761-A1 BICYCLIC PHENOL COMPOUNDS AND USE THEREOF MEDSHINE DISCOVERY INC. (CN) 2024-07-18 US disclosed
EP-0606661-B1 Octahydrophenanthrene derivatives and their use as NMDA-Antagonists HOFFMANN LA ROCHE (CH) 1997-03-12 EP disclosed
US-5385947-A For prevention of nerve damage due to reduction of blood or oxygen supplies HOFFMANN-LA ROCHE INC. (US) 1995-01-31 US disclosed
EP-0606661-A1 Octahydrophenanthrene derivatives and their use as NMDA-Antagonists F. HOFFMANN-LA ROCHE AG (CH) 1994-07-20 EP disclosed
US-4420480-A PARKINSONISM, DEPRESSION, HYPOTENSIVES MERCK & CO., INC. (US) 1983-12-13 US disclosed
EP-0080115-A2 Hexahydronaphth(1,2-b)-1,4-oxazines, process for their preparation and pharmaceutical formulation containing them MERCK & CO. INC. (US) 1983-06-01 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240239761-A1 BICYCLIC PHENOL COMPOUNDS AND USE THEREOF CYP3A43, CYP11B2, UGT2B7 MAOA 320/4885MAOB 135/4885BRD4 53/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.