SCHEMBL359880

SCHEMBL359880

Nc1nc2cc(C(F)(F)F)c(F)cc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 3/20 0.54
EPHX2 P34913 1/20 0.54
AXL P30530 1/20 0.50
GFER P55789 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 3/20 0.49
TP53 P04637 2/20 0.49
CYP3A4 P08684 2/20 0.49
TSHR P16473 1/20 0.49
MPL P40238 3/20 0.48
RAB9A P51151 4/20 0.46
LMNA P02545 3/20 0.46
NPC1 O15118 3/20 0.46
HSD17B10 Q99714 3/20 0.46
GAA P10253 2/20 0.46
PKM P14618 2/20 0.46
KCNH2 Q12809 1/20 0.46
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL5679546 0.93 SCN4A (0.54) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL21091220 0.81 SCN4A (0.53) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL210148 0.81 AXL (0.60) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL29801372 0.81 AXL (0.60) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL359912 0.79 KMT2A (0.36) SCN4AEPHX2MPLHSD17B10HPGD
SCHEMBL360218 0.75 AXL (0.53) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL19709634 0.75 AXL (0.53) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL1829710 0.75 AXL (0.53) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL1638626 0.75 AXL (0.53) SCN4AEPHX2AXLGFERSMN1; SMN2
SCHEMBL30002611 0.75 SMN1; SMN2 (0.72) SCN4AEPHX2AXLGFERSMN1; SMN2

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
WO-2012007510-A1 COMPOUNDS FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-19 WO disclosed