SCHEMBL7809564

SCHEMBL7809564

CSc1c(C(C)=O)c(=O)[nH]c2c(C(F)(F)F)cccc12

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.46
KIF11 P52732 1/20 0.44
KDM4E B2RXH2 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
PARP1 P09874 2/20 0.41
HSD17B10 Q99714 1/20 0.40
PADI4 Q9UM07 1/20 0.38
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
MPL P40238 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL9714150 0.85 CAPN1 (0.43) CAPN1KIF11KDM4ESMN1; SMN2MEN1
SCHEMBL7809628 0.83 KDM4E (0.43) KDM4EPARP1PADI4
SCHEMBL7817120 0.82 CAPN1 (0.44) CAPN1KIF11KDM4ESMN1; SMN2MEN1
SCHEMBL7810952 0.80 RXFP1 (0.47) KDM4EPADI4
SCHEMBL7809688 0.80 CAPN1 (0.40) CAPN1KDM4EALDH1A1HSD17B10PADI4
SCHEMBL7809501 0.80 CAPN1 (0.34) CAPN1KDM4EMEN1KMT2APADI4
SCHEMBL7816993 0.77 KDM4E (0.41) KDM4EMEN1ALDH1A1LMNAPOLB
SCHEMBL7811182 0.76 KDM4E (0.43) KDM4EMEN1ALDH1A1LMNAHPGD
SCHEMBL7817118 0.75 CAPN1 (0.42) CAPN1KIF11KDM4ESMN1; SMN2MEN1
SCHEMBL7816823 0.75 KDM4E (0.65) KDM4ESMN1; SMN2MEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0533882-B1 2-QUINOLINONE DERIVATIVES, METHODS FOR PREPARING THE SAME AND FUNGICIDES AND INSECTICIDES INCLUDING THEM KOREA RES INST CHEM TECH (KR) 2001-02-07 EP disclosed
EP-0533882-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-03-31 EP disclosed
WO-1992017452-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-10-15 WO disclosed