SCHEMBL6430249

SCHEMBL6430249

CCC(CC)CNc1ccnc(Oc2c(C)cc(Cl)cc2C)c1N

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 4/20 0.33
CRHR1 P34998 2/20 0.33
PDGFRB P09619 1/20 0.32
KDR P35968 1/20 0.32
SCN9A Q15858 1/20 0.31
ATM Q13315 1/20 0.30
USP7 Q93009 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
SCHEMBL6428405 0.87 HTR1A (0.35) SCN4ASCN9AATM
SCHEMBL6430830 0.80 CRHR1 (0.40) CRHR1
SCHEMBL5843648 0.74 CRHR1 (0.46) CRHR1
SCHEMBL6445881 0.73 PDGFRB (0.36) CRHR1PDGFRBKDRATM
SCHEMBL6428305 0.70 CRHR1 (0.44) CRHR1SCN9A
SCHEMBL6430481 0.68 LMNA (0.39) CRHR1ATM
SCHEMBL5842899 0.68 CRHR1 (0.62) CRHR1
SCHEMBL6430253 0.68 CRHR1 (0.42) SCN4ACRHR1SCN9A
SCHEMBL6430364 0.68 CRHR1 (0.39) SCN4ACRHR1SCN9A
SCHEMBL6450221 0.68 CRHR1 (0.39) CRHR1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6844351-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-01-18 US disclosed