SCHEMBL3844049

SCHEMBL3844049

CSCn1nnnc1Cc1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 9/20 0.41
CNKSR1 Q969H4 1/20 0.35
IL15 P40933 2/20 0.34
IL15RA Q13261 2/20 0.34
IL2 P60568 1/20 0.34
POLB P06746 1/20 0.34
HSD11B1 P28845 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL13617371 0.93 CRHR1 (0.37) CRHR1IL15IL15RA
SCHEMBL3843615 0.89 CRHR1 (0.40) CRHR1CNKSR1IL15IL15RAIL2
SCHEMBL3843569 0.88 CRHR1 (0.44) CRHR1HSD11B1
SCHEMBL3843991 0.85 CRHR1 (0.38) CRHR1CNKSR1IL15IL15RAIL2
SCHEMBL3842455 0.83 CRHR1 (0.41) CRHR1CNKSR1HSD11B1
SCHEMBL3839759 0.82 CRHR1 (0.39) CRHR1POLBHSD11B1
SCHEMBL3839291 0.80 CRHR1 (0.37) CRHR1CNKSR1POLBHSD11B1ALDH1A1
SCHEMBL3364574 0.78 CRHR1 (0.50) CRHR1HSD11B1
SCHEMBL3839810 0.78 CRHR1 (0.44) CRHR1HSD11B1
SCHEMBL3843300 0.77 SMN1; SMN2 (0.37) CRHR1POLBALDH1A1

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 7 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
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
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 96/4885CNKSR1 705/4885IL15 3791/4885

“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.