SCHEMBL7825449

SCHEMBL7825449

COc1ccc(-c2c(C(C3CC3)C3CC3)nn(C)c2N)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 8/20 0.36
TLR8 Q9NR97 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL7833816 0.70 CRHR1 (0.37) CRHR1
SCHEMBL7833843 0.70 CRHR1 (0.35) CRHR1
SCHEMBL20697905 0.68 MAPT (0.36) CRHR1TLR8POLB
SCHEMBL17178230 0.64 CYP1A2 (0.48)
SCHEMBL17178249 0.64 NPC1 (0.51) CRHR1TLR8POLB
SCHEMBL6082788 0.64 CRHR1 (0.39) CRHR1TLR8
SCHEMBL15698778 0.64 POLB (0.51) CRHR1POLB
SCHEMBL5107615 0.64 POLB (0.45) CRHR1POLB
SCHEMBL12326180 0.63 CA1 (0.50)
SCHEMBL27212614 0.63 POLB (0.47) POLB

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-1090005-A1 PYRAZOLO 1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2001-04-11 EP claimed
WO-1999067247-A1 PYRAZOLO[1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-29 WO claimed
EP-1090005-A1 PYRAZOLO 1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2001-04-11 EP disclosed
WO-1999067247-A1 PYRAZOLO[1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-29 WO disclosed