SCHEMBL7933048

SCHEMBL7933048

CCCCNc1c(F)c2c(c(Sc3ccccc3)c1Nc1c(OCC)cccc1OCC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.31
TSHR P16473 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
LMNA P02545 2/20 0.30
CYP19A1 P11511 1/20 0.30
EGFR P00533 1/20 0.30
PIM1 P11309 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
KEAP1 Q14145 1/20 0.30
PLEC Q15149 1/20 0.30
NFE2L2 Q16236 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7929922 0.91 TP53 (0.36) TP53MAPTTSHRL3MBTL1LMNA
SCHEMBL7928244 0.86 CYP19A1 (0.35) TSHRL3MBTL1LMNACYP19A1EGFR
SCHEMBL7930689 0.86 P4HB (0.36) CYP19A1EGFRPIM1MEN1RECQL
SCHEMBL7930025 0.82 CYP19A1 (0.34) TSHRLMNACYP19A1EGFRPIM1
SCHEMBL7927154 0.79 P4HB (0.39) EGFRPIM1MEN1RECQLKMT2A
SCHEMBL7930589 0.78 EGFR (0.43) TP53MAPTTSHRL3MBTL1EGFR
SCHEMBL7930651 0.75 EGFR (0.41) TP53MAPTTSHREGFRPIM1
SCHEMBL7930584 0.74 HDAC1 (0.40) MAPTL3MBTL1LMNACYP19A1MEN1
SCHEMBL7930675 0.73 SOAT1 (0.37)
SCHEMBL7933104 0.72 EGFR (0.40) MAPTLMNAEGFRPIM1MEN1

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