SCHEMBL3840103

SCHEMBL3840103

NCc1cc(F)cnc1-c1nc(Cl)c(Cc2cn(S(=O)(=O)c3ccccc3)c3ncc(Cl)cc23)s1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.35
BRD4 O60885 1/20 0.33
CCNE1 P24864 1/20 0.32
CDK2 P24941 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
SCHEMBL1266828 0.81 HTR6 (0.38) HTR6BRD4CCNE1CDK2
SCHEMBL3829505 0.77 CYP2C9 (0.39) HTR6BRD4CCNE1CDK2
SCHEMBL21294221 0.72 BRD4 (0.39) HTR6BRD4CCNE1CDK2
SCHEMBL3862087 0.71 LCK (0.36) HTR6BRD4CCNE1CDK2
SCHEMBL12675766 0.71 HTR6 (0.39) HTR6BRD4CCNE1CDK2
SCHEMBL3841208 0.70 HTR6 (0.40) HTR6BRD4CCNE1CDK2
SCHEMBL1268390 0.70 CYP2C9 (0.41) HTR6BRD4CCNE1CDK2
SCHEMBL1266811 0.70 BRD4 (0.40) HTR6BRD4CCNE1CDK2
SCHEMBL1267716 0.69 HTR6 (0.51) HTR6CCNE1CDK2
SCHEMBL28108723 0.69 HTR6 (0.39) HTR6BRD4CCNE1CDK2

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
EP-2086972-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2009-08-12 EP disclosed
WO-2008064255-A2 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON, INC. (US) 2008-05-29 WO disclosed