SCHEMBL3672724

SCHEMBL3672724

Cc1[c]ncc(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 16/20 0.68
MAOB P27338 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL3670946 0.82 CRHR1 (0.64) CRHR1MAOB
SCHEMBL3748976 0.81 CRHR1 (0.90) CRHR1MAOB
SCHEMBL3750761 0.81 CRHR1 (1.00) CRHR1MAOB
SCHEMBL3756151 0.80 CRHR1 (0.85) CRHR1
SCHEMBL3754443 0.79 CRHR1 (1.00) CRHR1MAOB
SCHEMBL4097723 0.79 CRHR1 (0.73) CRHR1
SCHEMBL13763756 0.79 CRHR1 (0.80) CRHR1MAOB
SCHEMBL3752749 0.79 CRHR1 (0.80) CRHR1MAOB
SCHEMBL3746202 0.79 CRHR1 (1.00) CRHR1
SCHEMBL3765127 0.79 CRHR1 (1.00) CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2240485-A1 TRICYCLIC COMPOUNDS HAVING CORTICOTROPIN-RELEASING FACTOR ANTAGONISTIC ACTIVITY AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Takeda Pharmaceutical Company Limited (JP) 2010-10-20 EP disclosed
WO-2009093747-A1 TRICYCLIC COMPOUNDS HAVING CORTICOTROPIN-RELEASING FACTOR ANTAGONISTIC ACTIVITY AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-07-30 WO disclosed