SCHEMBL14197872

SCHEMBL14197872

CC(C)(C)OC(=O)Nc1nc(Cl)c(C(O)c2c[nH]c3ncc(Cl)cc23)s1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LCK P06239 11/20 0.38
TRPA1 O75762 1/20 0.32
ATR Q13535 1/20 0.32
S1PR3 Q99500 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
SCHEMBL3862095 0.85 LCK (0.37) LCKS1PR3
SCHEMBL19829825 0.77 BRD4 (0.40) LCKTRPA1S1PR3
SCHEMBL29353882 0.72 LCK (0.45) LCK
SCHEMBL21384103 0.72 LCK (0.45) LCK
SCHEMBL30499449 0.71 LCK (0.48) LCK
SCHEMBL31321350 0.71 LCK (0.48) LCK
SCHEMBL18211757 0.69 BRD4 (0.39) LCKTRPA1S1PR3
SCHEMBL12675269 0.68 BRD4 (0.34) LCK
SCHEMBL8941838 0.67 BTK (0.47) LCK
SCHEMBL21872980 0.66 JAK2 (0.41) LCK

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
WO-2008064255-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 WO disclosed