SCHEMBL3845170

SCHEMBL3845170

CO/C=C/c1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 14/20 0.47
HSD11B1 P28845 3/20 0.36
F2RL3 Q96RI0 1/20 0.34
TNKS O95271 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
SCHEMBL3845172 1.00 CRHR1 (0.47) CRHR1HSD11B1F2RL3TNKS
SCHEMBL3364091 0.83 CRHR1 (0.50) CRHR1HSD11B1F2RL3TNKS
SCHEMBL3366932 0.83 CRHR1 (0.52) CRHR1HSD11B1F2RL3TNKS
SCHEMBL3841740 0.83 CRHR1 (0.45) CRHR1HSD11B1F2RL3
SCHEMBL3841741 0.83 CRHR1 (0.45) CRHR1HSD11B1F2RL3
SCHEMBL14206573 0.83 CRHR1 (0.46) CRHR1HSD11B1F2RL3
SCHEMBL3363999 0.83 CRHR1 (0.46) CRHR1HSD11B1F2RL3
SCHEMBL3399007 0.79 CRHR1 (0.53) CRHR1HSD11B1F2RL3TNKS
SCHEMBL3364854 0.79 CRHR1 (0.56) CRHR1HSD11B1F2RL3TNKS
SCHEMBL3838897 0.78 CRHR1 (0.41) CRHR1HSD11B1F2RL3

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 4 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

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 96/4885HSD11B1 480/4885F2RL3 936/4885

“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.