SCHEMBL6002297

SCHEMBL6002297

CN1C(=O)C2CC2(c2ccc(F)cc2)C1=O

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.72
BACE1 P56817 3/20 0.39
MAOB P27338 2/20 0.37
MAOA P21397 1/20 0.37
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP3A4 P08684 1/20 0.34
LIG1 P18858 1/20 0.34

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
SCHEMBL2779577 0.84 CYP19A1 (1.00) CYP19A1
SCHEMBL11076987 0.84 CYP19A1 (0.72) CYP19A1BACE1MAOBMAOAALDH1A1
SCHEMBL11078445 0.83 CYP19A1 (0.71) CYP19A1BACE1ALDH1A1
SCHEMBL4190208 0.83 CYP19A1 (0.62) CYP19A1BACE1
SCHEMBL6003496 0.83 CYP19A1 (0.67) CYP19A1MAOBMAOA
SCHEMBL10530117 0.81 CYP19A1 (0.68) CYP19A1
SCHEMBL10532320 0.81 CYP19A1 (0.68) CYP19A1ALDH1A1GAA
SCHEMBL4184614 0.81 CYP19A1 (0.59) CYP19A1BACE1POLB
SCHEMBL4181298 0.81 CYP19A1 (0.59) CYP19A1BACE1
SCHEMBL4771129 0.80 CYP19A1 (0.58) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060223875-A1 Methods and compositions for production, formulation and use of 1-aryl-3-azabicyclo[3.1.0]hexanes DOV PHARMACEUTICAL, INC. 2006-10-05 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-20060223875-A1 Methods and compositions for production, formulation and use of 1-aryl-3-azabicyclo[3.1.0]hexanes HTR1B, SLC6A3, CYP1B1 CYP19A1 461/4885BACE1 469/4885MAOB 22/4885

“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.