SCHEMBL779793

SCHEMBL779793

CON(C)C(=O)C1CCOc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.38
SSTR4 P31391 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
MAPK1 P28482 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
HTR2A P28223 1/20 0.34
MAP3K14 Q99558 1/20 0.34
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL28452015 0.85 P2RX7 (0.41) P2RX7SSTR4MEN1KMT2AUSP2
SCHEMBL29724343 0.80 SSTR4 (0.43) SSTR4PTGDR2KMT2AMAPK1SMN1; SMN2
SCHEMBL5846877 0.80 SSTR4 (0.43) SSTR4PTGDR2KMT2AMAPK1SMN1; SMN2
SCHEMBL5846881 0.80 SSTR4 (0.43) SSTR4PTGDR2KMT2AMAPK1SMN1; SMN2
SCHEMBL5846872 0.80 SSTR4 (0.43) SSTR4PTGDR2KMT2AMAPK1SMN1; SMN2
SCHEMBL17526341 0.77 SSTR4 (0.38) SSTR4PTGDR2MAPK1SMN1; SMN2GAA
SCHEMBL6682114 0.76 SSTR4 (0.35) SSTR4MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL5847643 0.76 SSTR4 (0.41) SSTR4PTGDR2SMN1; SMN2GAA
SCHEMBL29948201 0.76 SSTR4 (0.41) SSTR4PTGDR2SMN1; SMN2GAA
SCHEMBL769058 0.76 SSTR4 (0.41) SSTR4PTGDR2SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120071506-A1 METHODS FOR TREATING CNS DISORDERS WITH BICYCLO-SUBSTITUTED 2-IMIDAZOLINE AND 2-IMIDAZOLES GALLEY GUIDO (DE) 2012-03-22 US disclosed
US-20120071506-A1 METHODS FOR TREATING CNS DISORDERS WITH BICYCLO-SUBSTITUTED 2-IMIDAZOLINE AND 2-IMIDAZOLES GALLEY GUIDO (DE) 2012-03-22 US disclosed
US-20070197620-A1 Methods for treating CNS disorders with bicyclo-substituted 2-imidazoline and 2-imidazoles HOFFMANN-LA ROCHE INC. 2007-08-23 US disclosed
US-20070197620-A1 Methods for treating CNS disorders with bicyclo-substituted 2-imidazoline and 2-imidazoles HOFFMANN-LA ROCHE INC. 2007-08-23 US disclosed
WO-2007085558-A1 USE OF 2-IMIDAZOLES FOR THE TREATMENT OF CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2007-08-02 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 (2 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-20120071506-A1 METHODS FOR TREATING CNS DISORDERS WITH BICYCLO-SUBSTITUTED 2-IMIDAZOLINE AND 2-IMIDAZOLES CRY1, PER2, GPR119 P2RX7 248/4885SSTR4 593/4885PTGDR2 1799/4885
US-20070197620-A1 Methods for treating CNS disorders with bicyclo-substituted 2-imidazoline and 2-imidazoles CRY1, PER2, GPR119 P2RX7 250/4885SSTR4 555/4885PTGDR2 1425/4885

“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.