SCHEMBL4047243

SCHEMBL4047243

COc1cc(-c2c(-c3ccncc3)nn3c4c(cnc23)C2(CCC4)CC(Br)CO2)ccc1Br

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.38

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
SCHEMBL4049173 0.77 BRAF (0.37) BRAF
SCHEMBL4046191 0.61 NPC1 (0.53) BRAF
SCHEMBL4052299 0.61 BRAF (0.40) BRAF
SCHEMBL4048461 0.61 BRAF (0.49) BRAF
SCHEMBL1016142 0.59 BRAF (0.64) BRAF
SCHEMBL31300130 0.59 MAPT (0.49)
SCHEMBL4047106 0.57 BRAF (0.51) BRAF
SCHEMBL4052889 0.56 BRAF (0.47) BRAF
SCHEMBL1013175 0.56 BRAF (1.00) BRAF
SCHEMBL1015711 0.55 BRAF (0.83) BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009108827-A1 FUSED TRICYCLIC PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-03 WO claimed
WO-2009108827-A1 FUSED TRICYCLIC PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-03 WO disclosed
WO-2009108827-A1 FUSED TRICYCLIC PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-03 WO disclosed