SCHEMBL3716079

SCHEMBL3716079

NC(=O)c1nc2cc(-c3cc(F)cc(Cl)c3)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.41
PGR P06401 5/20 0.41
MAP2 P11137 1/20 0.38
CHEK2 O96017 5/20 0.38
MGLL Q99685 2/20 0.37
LIPC P11150 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 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
SCHEMBL14964175 0.90 CHEK2 (0.45) MAP4K4PGRCHEK2
SCHEMBL14655238 0.85 ICMT (0.47) PGRMAP2CHEK2
SCHEMBL3726438 0.83 PARP1 (0.50) MAP4K4PGRMAP2CHEK2
SCHEMBL3716080 0.80 MAP4K4 (0.49) MAP4K4PGRPIM1PIM2
Bromide SCHEMBL118833 0.79 MAP4K4 (0.48) MAP4K4PGRPIM1PIM2
Bromide SCHEMBL2380345 0.79 MAP4K4 (0.48) MAP4K4PGRPIM1PIM2
SCHEMBL9107283 0.78 HRH4 (0.44) MAP2CHEK2
SCHEMBL3064168 0.78 KMT2A (0.46) MAP2CHEK2
SCHEMBL30707784 0.78 HRH4 (0.44) MAP2CHEK2
SCHEMBL29414225 0.78 KMT2A (0.46) MAP2CHEK2

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
US-8450354-B2 Substituted imidazo[1,2-b]pyridazine derivatives, pharmaceutical compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-05-28 US claimed
US-8450354-B2 Substituted imidazo[1,2-b]pyridazine derivatives, pharmaceutical compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-05-28 US disclosed
EP-2549874-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS BETA-SECRETASE INHIBITORS High Point Pharmaceuticals, LLC (US) 2013-01-30 EP disclosed
WO-2010126745-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS β-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-04 WO disclosed