SCHEMBL7928567

SCHEMBL7928567

CCCCCCCCOc1c(Nc2c(C)cccc2C(=O)OCC)c(Nc2c(C)cccc2C(=O)OCC)cc2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
THRB P10828 1/20 0.36
CDC25B P30305 1/20 0.35
KDM4E B2RXH2 1/20 0.35
KDM4A O75164 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
METTL3 Q86U44 1/20 0.34

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
SCHEMBL7927286 0.97 THRB (0.38) LMNATSHRTHRBCDC25BKDM4E
SCHEMBL7929802 0.85 TSHR (0.38) LMNATSHRALDH1A1THRBCDC25B
SCHEMBL7927118 0.84 TSHR (0.38) LMNATSHRALDH1A1THRBCDC25B
SCHEMBL7930852 0.83 CDC25B (0.48) LMNAALDH1A1THRBCDC25BKDM4E
SCHEMBL7921067 0.82 MAPT (0.46) TSHRALDH1A1THRBCDC25BKDM4E
SCHEMBL7930692 0.81 USP2 (0.37) TSHRTHRBCDC25BMAPTTP53
SCHEMBL7933237 0.81 METTL3 (0.38) TSHRALDH1A1THRBCDC25BMAPT
SCHEMBL7930575 0.79 MEN1 (0.39) ALDH1A1KDM4EMAPT
SCHEMBL7930487 0.77 P2RY1 (0.36)
SCHEMBL7933072 0.75 CA12 (0.43) LMNATSHRALDH1A1THRBCDC25B

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