SCHEMBL11026437

SCHEMBL11026437

CN1CC(=O)Nc2ccc(OCc3ccccc3)cc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.58
MAOA P21397 10/20 0.58
CREBBP Q92793 2/20 0.57
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
TOP1 P11387 1/20 0.47
BRD4 O60885 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL11024441 0.81 MEN1 (0.56) MAOBMAOAMEN1KMT2APDE3B
SCHEMBL10632075 0.79 MEN1 (0.65) MAOBMAOAMEN1KMT2APDE3B
SCHEMBL29289947 0.79 MAOB (0.58) MAOBMAOATOP1HRH3
SCHEMBL31098653 0.79 MAOB (0.58) MAOBMAOATOP1HRH3
SCHEMBL9728150 0.74 MAOB (1.00) MAOBMAOATOP1
SCHEMBL20520341 0.74 MAOA (0.79) MAOBMAOACREBBPTOP1
SCHEMBL9893281 0.74 CREBBP (0.57) MAOBMAOACREBBPMEN1KMT2A
SCHEMBL11028170 0.74 MEN1 (0.73) MAOBMAOACREBBPMEN1KMT2A
SCHEMBL11685320 0.74 MEN1 (0.50) MAOBMAOAMEN1KMT2A
SCHEMBL4751126 0.73 MAOB (0.78) MAOBMAOACREBBPPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120189547-A1 [18F] LABELLED ANALOGUES OF FLUMAZENIL AS IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2012-07-26 US disclosed
US-20120189547-A1 [18F] LABELLED ANALOGUES OF FLUMAZENIL AS IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2012-07-26 US disclosed
WO-2011042550-A1 [18 F] - LABELLED ANALOGUES OF FLUMAZENIL AS IN VIVO IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2011-04-14 WO 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-20120189547-A1 [18F] LABELLED ANALOGUES OF FLUMAZENIL AS IN VIVO IMAGING AGENTS GABRA5, GABRA4, GABRA2 MAOB 248/4885MAOA 209/4885CREBBP 4089/4885

“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.