SCHEMBL3840277

SCHEMBL3840277

CN(C)S(=O)(=O)n1c(C(O)c2c3cccc(-c4ccc(Cl)cc4Cl)c3nn2C)cnc1[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.32
F2RL3 Q96RI0 1/20 0.32
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31

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
SCHEMBL14377983 0.87 CRHR1 (0.37) CRHR1F2RL3CYP3A4MAPTCYP2C9
SCHEMBL3839446 0.77 CRHR1 (0.36) CRHR1F2RL3
SCHEMBL3365798 0.71 CRHR1 (0.49) CRHR1F2RL3
SCHEMBL13617373 0.70 CRHR1 (0.39) CRHR1F2RL3
SCHEMBL13617365 0.69 CRHR1 (0.41) CRHR1
SCHEMBL13617783 0.69 CRHR1 (0.41) CRHR1F2RL3
SCHEMBL3362573 0.68 CRHR1 (0.46) CRHR1F2RL3
SCHEMBL3841761 0.68 CRHR1 (0.42) CRHR1
SCHEMBL3367536 0.67 CRHR1 (0.49) CRHR1F2RL3
SCHEMBL3366885 0.66 CRHR1 (0.48) CRHR1F2RL3

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
EP-2007753-B1 HETEROCYCLIC GABA ALPHA SUBTYPE SELECTIVE RECEPTOR MODULATORS HOFFMANN LA ROCHE (CH) 2009-11-11 EP disclosed
EP-2007753-A1 HETEROCYCLIC GABA ALPHA SUBTYPE SELECTIVE RECEPTOR MODULATORS F. Hoffmann-Roche AG (CH) 2008-12-31 EP disclosed
WO-2007115966-A1 HETEROCYCLIC GABA ALPHA SUBTYPE SELECTIVE RECEPTOR MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2007-10-18 WO disclosed
US-20070238765-A1 Heterocyclic GABAA subtype selective receptor modulators ROCHE PALO ALTO LLC 2007-10-11 US disclosed
US-20070238765-A1 Heterocyclic GABAA subtype selective receptor modulators ROCHE PALO ALTO LLC 2007-10-11 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-20070238765-A1 Heterocyclic GABAA subtype selective receptor modulators GABRA1, GABRA2, GABRA3 CRHR1 96/4885F2RL3 936/4885CYP3A4 168/4885

“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.