SCHEMBL19129507

SCHEMBL19129507

COc1cc(C)cc2oc(-c3ccc(OCCN4CCN(C)CC4)cc3)cc(=O)c12

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 2/20 0.56
▸ MAOB P27338 2/20 0.56
▸ BCHE P06276 4/20 0.56
▸ ACHE P22303 4/20 0.56
▸ ABCB1 P08183 1/20 0.54
▸ BRD4 O60885 2/20 0.53
▸ BRD2 P25440 2/20 0.53
▸ BRD3 Q15059 2/20 0.53
▸ BRDT Q58F21 2/20 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
SCHEMBL19129478 0.93 ACHE (0.64) MAOAMAOBBCHEACHEABCB1
SCHEMBL19129535 0.92 ACHE (0.63) MAOAMAOBBCHEACHEABCB1
SCHEMBL17185545 0.92 ABCB1 (0.65) MAOAMAOBBCHEACHEABCB1
SCHEMBL19129533 0.91 BCHE (0.66) MAOAMAOBBCHEACHEABCB1
SCHEMBL17193743 0.85 BCHE (0.70) MAOAMAOBBCHEACHEABCB1
SCHEMBL17185529 0.84 ACHE (0.68) MAOAMAOBBCHEACHEABCB1
SCHEMBL19129476 0.84 MAOB (0.54) MAOAMAOBBCHEACHEABCB1
SCHEMBL17185531 0.83 BCHE (0.71) MAOAMAOBBCHEACHEABCB1
SCHEMBL19129531 0.83 MAOB (0.67) MAOAMAOBABCB1BRD4
SCHEMBL19129474 0.83 MAOB (0.64) MAOAMAOBABCB1

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-9868715-B2 Apigenin analogs, compositions, and methods related thereto THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEMS (US) 2018-01-16 — — US disclosed
US-20170204078-A1 APIGENIN ANALOGS, COMPOSITIONS, AND METHODS RELATED THERETO THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-07-20 — — US 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-20170204078-A1 APIGENIN ANALOGS, COMPOSITIONS, AND METHODS RELATED THERETO CBS, CTH, PTGIS MAOA 1595/4885MAOB 1245/4885BCHE 142/4885

“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.

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