SCHEMBL6177063

SCHEMBL6177063

CN(C(=O)Cc1ccc(F)cc1Cl)c1c(-c2ccncc2)c(-c2ccc(F)cc2)nn1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.47
SRC P12931 3/20 0.43
BRAF P15056 3/20 0.43
KDR P35968 3/20 0.43
RIPK2 O43353 1/20 0.43
EGFR P00533 1/20 0.43
TNK2 Q07912 1/20 0.43
PTK6 Q13882 1/20 0.43
MINK1 Q8N4C8 1/20 0.43
P2RX7 Q99572 5/20 0.42
CSNK1D P48730 2/20 0.39
CSNK1E P49674 2/20 0.39
MAPK13 O15264 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
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
SCHEMBL6178114 0.90 MAPK14 (0.47) MAPK14SRCBRAFKDRRIPK2
SCHEMBL6178593 0.89 MAPK14 (0.48) MAPK14SRCBRAFKDRRIPK2
SCHEMBL6177608 0.86 MAPK14 (0.47) MAPK14SRCBRAFKDRRIPK2
SCHEMBL6179013 0.86 MAPK14 (0.53) MAPK14SRCBRAFKDREGFR
SCHEMBL6176784 0.86 MAPK14 (0.53) MAPK14SRCBRAFKDREGFR
SCHEMBL6177991 0.85 MAPK14 (0.48) MAPK14SRCBRAFKDREGFR
SCHEMBL6190581 0.83 MAPK14 (0.47) MAPK14SRCBRAFKDREGFR
SCHEMBL4336481 0.83 MAPK14 (0.57) MAPK14SRCBRAFKDREGFR
SCHEMBL6176619 0.83 MAPK14 (0.46) MAPK14SRCBRAFKDREGFR
SCHEMBL6175734 0.80 MAPK14 (0.48) MAPK14SRCBRAFKDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1326848-C Aminopyrazole derivatives TEIKOKU HORMONE MFG CO LTD (JP) 2007-07-18 CN disclosed
EP-1142890-B1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2005-08-03 EP disclosed
US-6511997-B1 For treatment of a disease associated with tumor necrosis factor alpha, interleukin 1, interleukin 6 or cyclooxygenase II; such as irritable bowel disease TEIKOKU HORMONE MFG. CO., LTD. (JP) 2003-01-28 US disclosed
CN-1331688-A Aminopyridine Derivatives TEIKOKU HORMONE MFG CO LTD (JP) 2002-01-16 CN disclosed
EP-1142890-A1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-10-10 EP disclosed