SCHEMBL14626324

SCHEMBL14626324

Cc1nc(-c2ccc(CI)nc2)cn1CCCCN

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 16/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
SPNS2 Q8IVW8 1/20 0.33
PDE10A Q9Y233 1/20 0.32

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
SCHEMBL14294462 0.85 TLR8 (0.40) TLR8CASP3SENP8SENP7SENP6
SCHEMBL14268999 0.82 TLR8 (0.42) TLR8CASP3SENP8SENP7SENP6
SCHEMBL14268994 0.81 CASP3 (0.46) TLR8CASP3SENP8SENP7SENP6
SCHEMBL14626241 0.77 MAPK13 (0.37)
SCHEMBL14625961 0.76 CYP3A4 (0.36) PDE10A
SCHEMBL4861475 0.76 TLR8 (0.62) TLR8PDE10A
SCHEMBL14269022 0.72 TLR8 (0.50) TLR8CASP3SENP8SENP7SENP6
SCHEMBL14269011 0.70 TLR8 (0.49) TLR8CASP3SENP8SENP7SENP6
SCHEMBL24289574 0.69 SSTR2 (0.40) TLR8
SCHEMBL27835092 0.66 CASP3 (0.39) TLR8CASP3SENP8SENP7SENP6

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-7163924-B2 Ketolide derivatives CHIRON CORPORATION (US) 2007-01-16 US disclosed