SCHEMBL16503550

SCHEMBL16503550

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CASP3 P42574 5/20 0.34
RORC P51449 1/20 0.33
RORB Q92753 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PABPC1 P11940 1/20 0.32
DNMT1 P26358 1/20 0.32
PGR P06401 1/20 0.31
EIF4E P06730 1/20 0.31
F2 P00734 1/20 0.30
PLG P00747 1/20 0.30
PLAU P00749 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
SCHEMBL7916768 0.84 KDM4E (0.38) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL16502518 0.84 PLA2G2D (0.44) KDM4ENPC1RAB9ASMN1; SMN2RORC
SCHEMBL16502514 0.80 TP53 (0.41) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL7916763 0.80 RAB9A (0.35) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL7915692 0.76 SLC9A1 (0.46)
SCHEMBL18342657 0.73 KDM4E (0.34) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL16503582 0.73 LMNA (0.34) RAB9ASMN1; SMN2MEN1KMT2AF2
SCHEMBL16503571 0.72 MCL1 (0.35) KDM4ERORCMEN1KMT2A
SCHEMBL16503581 0.71 AKR1C3 (0.36) KDM4ERAB9ACASP3MEN1KMT2A
SCHEMBL7921972 0.71 MEN1 (0.40) KDM4ENPC1RAB9ASMN1; SMN2CASP3

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-2394987-A1 ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2011-12-14 EP disclosed