SCHEMBL7816993

SCHEMBL7816993

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
PADI4 Q9UM07 1/20 0.38
HSD17B10 Q99714 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
PLA2G7 Q13093 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MCL1 Q07820 1/20 0.33
ELANE P08246 1/20 0.32
GALR3 O60755 2/20 0.32
ALDH1A1 P00352 2/20 0.32
RAB9A P51151 1/20 0.32
PPARG P37231 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL7809479 0.81 KDM4E (0.36) KDM4EHSD17B10CA1CA2HPGD
SCHEMBL7809628 0.80 KDM4E (0.43) KDM4EPADI4TDP1
SCHEMBL7810952 0.80 RXFP1 (0.47) KDM4EPADI4RXFP1
SCHEMBL7809564 0.77 CAPN1 (0.46) KDM4EPADI4HSD17B10HPGDMEN1
SCHEMBL7811182 0.76 KDM4E (0.43) KDM4EPADI4HSD17B10HPGDMEN1
SCHEMBL7816823 0.75 KDM4E (0.65) KDM4EPADI4HSD17B10HPGDMEN1
SCHEMBL29612326 0.75 KDM4E (0.65) KDM4EPADI4HSD17B10HPGDMEN1
SCHEMBL7809476 0.74 PLA2G7 (0.34) KDM4EHSD17B10CA1CA2HPGD
SCHEMBL3358803 0.67 FASN (0.40) KDM4ECA1CA2MCL1ALDH1A1
SCHEMBL9389330 0.67 KDM4E (0.43) KDM4ECA1CA2PLA2G7TDP1

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 4 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
US-5430153-A Insecticides, fungicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-04 US 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