SCHEMBL13874263

SCHEMBL13874263

SCc1ccc(-c2cnc3ccc(Br)cn23)s1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.45
FLT3 P36888 11/20 0.42
PIK3CA P42336 2/20 0.42
MTOR P42345 2/20 0.42
MKNK1 Q9BUB5 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
FYN P06241 3/20 0.33

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
SCHEMBL13874265 0.82 SRC (0.46) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3847902 0.80 SLC2A1 (0.47) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3845076 0.77 FLT3 (0.44) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3846450 0.75 FLT3 (0.50) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL13873996 0.75 FLT3 (0.43) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3848841 0.75 PIK3CA (0.43) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3871609 0.74 SMYD3 (0.39) MAP3K14MKNK1MKNK2
SCHEMBL3868735 0.73 LMNA (0.40) MAP3K14PIK3CAMKNK1MKNK2
SCHEMBL15756965 0.69 MAP3K14 (0.54) MAP3K14FLT3PIK3CAMTORMKNK1
SCHEMBL3849727 0.69 PIK3CA (0.53) MAP3K14FLT3PIK3CAMTORFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2048142-A2 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed