SCHEMBL4325142

SCHEMBL4325142

Cc1nc(Cl)c(N)c(Nc2c(F)cc(Br)cc2F)n1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.36
WDR5 P61964 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
EGFR P00533 1/20 0.32
KDR P35968 1/20 0.32
DHODH Q02127 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
Hydrochloric Acid SCHEMBL4324878 0.99 CRHR1 (0.36) CRHR1WDR5KMT2ATP53MAPT
SCHEMBL13578902 0.74 WDR5 (0.43) WDR5KMT2AMAPTEGFRKDR
SCHEMBL13578882 0.71 EGFR (0.42) WDR5KMT2AMAPTEGFRKDR
SCHEMBL13578880 0.70 KMT2A (0.43) CRHR1WDR5KMT2AMAPTEGFR
SCHEMBL13578886 0.70 MAPK1 (0.50) WDR5KMT2ATP53EGFRKDR
SCHEMBL13578892 0.69 PIK3CA (0.54) KMT2ATP53MAPTEGFRKDR
SCHEMBL13578869 0.69 KDR (0.43) CRHR1WDR5KMT2AMAPTEGFR
SCHEMBL8032963 0.69 CRHR1 (0.36) CRHR1WDR5KMT2AEGFRKDR
SCHEMBL5236485 0.68 KDR (0.51) WDR5KMT2ATP53MAPTEGFR
SCHEMBL4319399 0.68 ALDH1A1 (0.43) WDR5KMT2AMAPT

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
WO-2009144632-A1 NOVEL COMPOUNDS PFIZER LIMITED (GB) 2009-12-03 WO disclosed
WO-2009144632-A1 NOVEL COMPOUNDS PFIZER LIMITED (GB) 2009-12-03 WO disclosed