SCHEMBL7920004

SCHEMBL7920004

C=C(OC)c1ccc2cccc(-c3c(F)cc(C)cc3F)c2c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
DHFR P00374 1/20 0.30
F2 P00734 1/20 0.30
PLG P00747 1/20 0.30
PLAT P00750 1/20 0.30
KLK1 P06870 1/20 0.30
PRSS1 P07477 1/20 0.30

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
SCHEMBL7908906 0.91 PLAU (0.34) PLAUMEN1KMT2AALDH1A1MAPT
SCHEMBL7916775 0.86 PLAU (0.32) PLAU
SCHEMBL7906753 0.83 MAPT (0.36) PLAUMEN1KMT2AALDH1A1MAPT
SCHEMBL7917796 0.82 PLAU (0.35) PLAUMEN1KMT2AALDH1A1MAPT
SCHEMBL7916572 0.81 HSD17B14 (0.37) PLAUMEN1KMT2AMAPT
SCHEMBL7919038 0.81 PLAU (0.36) PLAUMEN1KMT2AMAPTRAB9A
SCHEMBL7911006 0.80 HDAC8 (0.40) PLAUMEN1KMT2AALDH1A1MAPT
SCHEMBL7916552 0.80 PLAU (0.34) PLAURAB9AF2PLGPLAT
SCHEMBL7915957 0.79 KDM4E (0.39) PLAUALDH1A1F2PLGPLAT
SCHEMBL7918428 0.79 SLC6A4 (0.40) PLAUMEN1KMT2AALDH1A1MAPT

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-2010090304-A1 ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-12 WO disclosed