SCHEMBL7921067

SCHEMBL7921067

CCCCCCCCOc1c(Nc2ccc(C(=O)OCC)cc2)c(Nc2ccc(C(=O)OCC)cc2)cc2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
TSHR P16473 1/20 0.45
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 3/20 0.41
THRB P10828 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
APAF1 O14727 1/20 0.41
MITF O75030 1/20 0.41
NR4A1 P22736 1/20 0.41
HTT P42858 1/20 0.41
SMAD3 P84022 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
TP53 P04637 1/20 0.40
SLC2A1 P11166 2/20 0.39
RAB9A P51151 1/20 0.39
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA1 P00915 1/20 0.38

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
SCHEMBL7930852 0.91 CDC25B (0.48) MAPTMEN1KMT2AHPGDTHRB
SCHEMBL7921187 0.84 MAPT (0.48) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7928410 0.84 MAPT (0.47) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7929952 0.83 MAPT (0.49) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7928567 0.82 LMNA (0.36) MAPTTSHRTHRBSMN1; SMN2KDM4E
SCHEMBL7928384 0.80 MAPT (0.49) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7929778 0.79 MAPT (0.51) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7927286 0.78 THRB (0.38) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7930660 0.78 STS (0.47) MAPTTSHRMEN1KMT2AHPGD
SCHEMBL7928461 0.77 STS (0.46) MAPTTSHRMEN1KMT2AHPGD

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