SCHEMBL4713638

SCHEMBL4713638

Cc1c(NC2CC2)c(C(=O)N(N)C(=O)OC(C)(C)C)cc(F)c1N1CCC(NC(=O)OC(C)(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.39
CTSK P43235 2/20 0.37
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
EGFR P00533 1/20 0.36
TEC P42680 1/20 0.36
TXK P42681 1/20 0.36
BMX P51813 1/20 0.36
JAK3 P52333 1/20 0.36
ITK Q08881 1/20 0.36
KCNH2 Q12809 1/20 0.36
ERBB4 Q15303 1/20 0.36
KDM4D Q6B0I6 4/20 0.36
SYK P43405 1/20 0.35
PARP1 P09874 1/20 0.35
TRPV1 Q8NER1 2/20 0.35

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
SCHEMBL7554372 0.91 KDM4D (0.38) BTKCTSKPIM1PIM3PIM2
SCHEMBL7514351 0.88 KDM4D (0.35) BTKCTSKPIM1PIM3PIM2
SCHEMBL7516546 0.88 BTK (0.39) BTKCTSKPIM1PIM3PIM2
SCHEMBL4515657 0.88 BTK (0.40) BTKCTSKPIM1PIM3PIM2
SCHEMBL7511874 0.86 SUV39H2 (0.38) BTKCTSKPIM1PIM3PIM2
SCHEMBL4506885 0.85 BTK (0.39) BTKCTSKPIM1PIM3PIM2
SCHEMBL7510364 0.85 SUV39H2 (0.40) KDM4D
SCHEMBL4514369 0.84 BTK (0.38) BTKCTSKPIM1PIM3PIM2
SCHEMBL7508482 0.84 BTK (0.38) BTKCTSKJAK3KDM4DTRPV1
SCHEMBL28750386 0.82 BTK (0.39) BTKCTSKPIM1PIM3PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255739-B1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2008-06-11 EP disclosed
EP-1255739-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2002-11-13 EP disclosed
WO-2001053273-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2001-07-26 WO disclosed