SCHEMBL7930684

SCHEMBL7930684

CCc1cccc(CC)c1Nc1c(Cl)c2c(c(Cl)c1Nc1c(CC)cccc1CC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.39
KCNH2 Q12809 2/20 0.38
SCN5A Q14524 2/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
ANPEP P15144 1/20 0.38
DPP4 P27487 1/20 0.38
CACNA1C Q13936 1/20 0.37
EGFR P00533 1/20 0.37
PIM1 P11309 1/20 0.37
ELANE P08246 2/20 0.36
CTSG P08311 2/20 0.36
MAPT P10636 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAOA P21397 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL7929886 0.94 CLCN2 (0.38) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL7929882 0.86 ELANE (0.34) KCNH2EGFRPIM1ELANECTSG
SCHEMBL7929945 0.84 CLCN2 (0.40) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL11330906 0.82 CLCN2 (0.48) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL7921158 0.81 CLCN2 (0.38) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL7927329 0.80 CLCN2 (0.38) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL7927150 0.78 SMN1; SMN2 (0.40) GABRA1GABRB2ANPEPDPP4EGFR
SCHEMBL7921215 0.77 CXCR2 (0.41) EGFRPIM1ELANECTSGMAPT
SCHEMBL7927333 0.77 CLCN2 (0.46) CLCN2KCNH2SCN5AGABRA1GABRB2
SCHEMBL7930637 0.76 EGFR (0.44) CLCN2KCNH2SCN5AANPEPDPP4

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-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed