SCHEMBL7809706

SCHEMBL7809706

CC(=O)c1c(SC(c2ccccc2)C(C)(C)C)c2cc(Cl)cc(C(F)(F)F)c2[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.37
KDM4E B2RXH2 1/20 0.34
MAP2 P11137 1/20 0.33
CSF1R P07333 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 2/20 0.32
POLB P06746 1/20 0.32
PCTP Q9UKL6 1/20 0.32
HSD17B2 P37059 1/20 0.32
ATM Q13315 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL7809688 0.79 CAPN1 (0.40) CAPN1KDM4EMAP2CSF1RALDH1A1
SCHEMBL7809700 0.77 CAPN1 (0.39) CAPN1KDM4ECSF1RALDH1A1MAPT
SCHEMBL7816816 0.74 ALDH1A1 (0.40) CAPN1ALDH1A1TP53RXFP1SMN1; SMN2
SCHEMBL8692854 0.73 CAPN1 (0.38) CAPN1
SCHEMBL7813860 0.72 CAPN1 (0.40) CAPN1KDM4EALDH1A1POLBNPSR1
SCHEMBL7810983 0.72 CAPN1 (0.44) CAPN1ALDH1A1MAPTTP53RXFP1
SCHEMBL497120 0.72 CAPN1 (0.39) CAPN1CSF1RMAPTTP53RXFP1
SCHEMBL7813747 0.71 CAPN1 (0.41) CAPN1KDM4ECSF1RALDH1A1MAPT
SCHEMBL8691893 0.71 CAPN1 (0.39) CAPN1KDM4EMAP2CSF1RALDH1A1
SCHEMBL8691019 0.70 CAPN1 (0.38) CAPN1CSF1RATMMEN1KMT2A

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