SCHEMBL7809688

SCHEMBL7809688

CSc1c(C(C)=O)c(=O)[nH]c2c(C(F)(F)F)cc(Cl)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.40
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
KDM4E B2RXH2 2/20 0.32
RHEB Q15382 1/20 0.31
MAP2 P11137 1/20 0.31
CSF1R P07333 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GAA P10253 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL7804199 0.89 CAPN1 (0.34) CAPN1MAPTCSF1RALDH1A1
SCHEMBL7809501 0.85 CAPN1 (0.34) CAPN1KDM4EPADI4
SCHEMBL497120 0.84 CAPN1 (0.39) CAPN1CDK4CCND1MAPTTP53
SCHEMBL7804202 0.82 GRIN1 (0.33) CAPN1MAPTCSF1RALDH1A1GRIN2D
SCHEMBL8692854 0.81 CAPN1 (0.38) CAPN1
SCHEMBL7813747 0.81 CAPN1 (0.41) CAPN1MAPTTP53RXFP1KDM4E
SCHEMBL8692858 0.80 CAPN1 (0.38) CAPN1MAPTTP53RXFP1
SCHEMBL7810983 0.80 CAPN1 (0.44) CAPN1MAPTTP53RXFP1ALDH1A1
SCHEMBL7813860 0.80 CAPN1 (0.40) CAPN1KDM4EALDH1A1CTSDCTSL
SCHEMBL7809564 0.80 CAPN1 (0.46) CAPN1KDM4EALDH1A1HSD17B10PADI4

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