SCHEMBL7916768

SCHEMBL7916768

C=C(O)c1ccc2cccc(-c3sccc3Cl)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CASP3 P42574 6/20 0.35
RORC P51449 1/20 0.34
RORB Q92753 1/20 0.34
PABPC1 P11940 1/20 0.33
DNMT1 P26358 1/20 0.33
PGR P06401 1/20 0.32
EIF4E P06730 1/20 0.32
F2 P00734 1/20 0.31
PLG P00747 1/20 0.31
PLAU P00749 1/20 0.31
PLAT P00750 1/20 0.31
KLK1 P06870 1/20 0.31
PRSS1 P07477 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL16502518 0.86 PLA2G2D (0.44) KDM4ENPC1RAB9ASMN1; SMN2RORC
SCHEMBL7916763 0.85 RAB9A (0.35) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL16503550 0.84 KDM4E (0.36) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL7921972 0.84 MEN1 (0.40) KDM4ENPC1RAB9ASMN1; SMN2CASP3
SCHEMBL16502514 0.80 TP53 (0.41) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL7918345 0.79 CYP1A2 (0.40) KDM4ENPC1RAB9ASMN1; SMN2CASP3
SCHEMBL7915692 0.78 SLC9A1 (0.46)
SCHEMBL18342657 0.77 KDM4E (0.34) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL16503576 0.74 HSP90AA1 (0.35) KDM4ESMN1; SMN2TDP1F2PLG
SCHEMBL7920129 0.73 TNF (0.45) KDM4ESMN1; SMN2TDP1CASP3F2

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