SCHEMBL6364740

SCHEMBL6364740

COc1ccc2c(c1)C/C(=C/O)C2=O

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.65
CYP19A1 P11511 2/20 0.62
MIF P14174 2/20 0.60
METAP1 P53582 1/20 0.59
MAOA P21397 3/20 0.59
ACHE P22303 6/20 0.58
BACE1 P56817 3/20 0.58
ABCB1 P08183 1/20 0.56
HSP90AA1 P07900 1/20 0.56
CES2 O00748 1/20 0.53
CYP26A1 O43174 1/20 0.53

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
SCHEMBL6364741 1.00 MAOB (0.65) MAOBCYP19A1MIFMETAP1MAOA
SCHEMBL4808965 0.92 MIF (0.61) MAOBCYP19A1MIFMETAP1MAOA
SCHEMBL4808970 0.92 MIF (0.61) MAOBCYP19A1MIFMETAP1MAOA
SCHEMBL6361514 0.86 MIF (0.67) CYP19A1MIFABCB1HSP90AA1CYP26A1
SCHEMBL12760787 0.86 MIF (0.67) CYP19A1MIFABCB1HSP90AA1CYP26A1
SCHEMBL30413650 0.81 MAOB (0.84) MAOBCYP19A1MIFMAOAACHE
SCHEMBL28927416 0.81 MAOB (0.84) MAOBCYP19A1MIFMAOAACHE
SCHEMBL6990912 0.81 MAOB (0.84) MAOBCYP19A1MIFMAOAACHE
SCHEMBL6361474 0.81 MAOB (0.67) MAOBCYP19A1MIFMETAP1MAOA
SCHEMBL6361472 0.81 MAOB (0.67) MAOBCYP19A1MIFMETAP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933392-B2 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma ALCON, INC. (CH) 2005-08-23 US disclosed
US-6884816-B2 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma ALCON, INC. (CH) 2005-04-26 US disclosed
US-20030181504-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma MAY JESSE A (US) 2003-09-25 US disclosed
US-20030181503-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma NOVARTIS AG (CH) 2003-09-25 US disclosed
US-20030083346-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma ALCON, INC. (CH) 2003-05-01 US disclosed
EP-0700905-B1 Tricyclic pyrazole derivatives HOFFMANN LA ROCHE (CH) 2001-10-31 EP disclosed
US-5561150-A 1-AMINOALKYL-1,4-DIHYDROINDENO(2,1-C)PYRAZOLES OR 1H-BENZ(G)INDAZOLES; SEROTONIN RECEPTOR ANTAGONISTS; ANTIDEPRESSANTS; NERVOUS SYSTEM, PSYCHOLOGICAL AND GASTROINTESTINAL DISORDERS HOFFMAN-LA ROCHE INC. (US) 1996-10-01 US disclosed
EP-0700905-A1 Tricyclic pyrazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1996-03-13 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 (3 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-20030181503-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma CYP11B1, CYP11B2, SQLE MAOB 955/4885CYP19A1 155/4885MIF 1874/4885
US-20030083346-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma CYP11B1, CYP11B2, SQLE MAOB 955/4885CYP19A1 155/4885MIF 1874/4885
US-20030181504-A1 Hydroxy substituted fused naphthyl-azoles and fused indeno-azoles and their use for the treatment of glaucoma CYP11B1, CYP11B2, SQLE MAOB 955/4885CYP19A1 155/4885MIF 1874/4885

“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.