SCHEMBL7813019

SCHEMBL7813019

CCC(=O)c1c(NC(C)C)c2cccc(Cl)c2[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.40
KDM4E B2RXH2 3/20 0.38
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
DAO P14920 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NLRP3 Q96P20 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DYRK1A Q13627 2/20 0.34
NR4A2 P43354 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
SCHEMBL7809443 0.74 RXFP1 (0.47) RXFP1KDM4ECDK1CCNB1DAO
SCHEMBL7813741 0.73 KDM4E (0.45) KDM4EDAOALDH1A1MEN1KMT2A
SCHEMBL7809440 0.71 RXFP1 (0.40) RXFP1KDM4ECDK1CCNB1DAO
SCHEMBL7803965 0.68 RXFP1 (0.52) RXFP1KDM4ECDK1CCNB1DAO
SCHEMBL7812826 0.66 KDM4E (0.38) KDM4EDAOALDH1A1MEN1KMT2A
SCHEMBL8239577 0.66 FEN1 (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL7810952 0.64 RXFP1 (0.47) RXFP1KDM4EDAODYRK1ANR4A2
SCHEMBL14017831 0.62 NR4A2 (0.43) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL3641835 0.62 DAO (0.49) RXFP1KDM4EDAOMEN1KMT2A
SCHEMBL6991969 0.62 DYRK1A (0.44) RXFP1KDM4ECDK1CCNB1DAO

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