SCHEMBL7366169

SCHEMBL7366169

Cc1cccc(C(=O)Nc2ccc3c(C(=O)OC(C)(C)C)n[nH]c3c2)c1N

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.43
MAP4K1 Q92918 1/20 0.43
JAK2 O60674 3/20 0.42
JAK1 P23458 3/20 0.42
KDR P35968 4/20 0.41
CSNK2A1 P68400 3/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
WNT1 P04628 1/20 0.39
DYRK1A Q13627 1/20 0.39
LMNA P02545 1/20 0.39
CDK2 P24941 1/20 0.39
NAMPT P43490 1/20 0.38

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
SCHEMBL7368010 0.89 FLT3 (0.46) FLT3MAP4K1JAK2JAK1CSNK2A1
SCHEMBL7367977 0.87 JAK2 (0.46) FLT3MAP4K1JAK2JAK1ALDH1A1
SCHEMBL7371218 0.85 MEN1 (0.53) FLT3MAP4K1CSNK2A1ALDH1A1SMN1; SMN2
SCHEMBL7366495 0.84 FLT3 (0.45) FLT3MAP4K1JAK2JAK1ALDH1A1
SCHEMBL7369363 0.83 TP53 (0.50) KDRSMN1; SMN2LMNANAMPT
SCHEMBL7370817 0.80 HTT (0.51) FLT3ALDH1A1SMN1; SMN2LMNA
SCHEMBL7365502 0.79 JAK2 (0.41) FLT3MAP4K1JAK2JAK1CSNK2A1
SCHEMBL7367473 0.79 SMN1; SMN2 (0.46) FLT3ALDH1A1SMN1; SMN2LMNACDK2
SCHEMBL7373717 0.79 NR1H4 (0.57) FLT3KDRSMN1; SMN2
SCHEMBL7368426 0.77 NPC1 (0.54) FLT3RXFP1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed