SCHEMBL7921206

SCHEMBL7921206

COc1c(F)c2c(c(F)c1Nc1c(C)cccc1Cl)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
PIM1 P11309 1/20 0.41
LCK P06239 13/20 0.39
AR P10275 2/20 0.37
PTGS2 P35354 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
SCHEMBL7921280 0.93 EGFR (0.45) EGFRPIM1AR
SCHEMBL7927337 0.92 EGFR (0.46) EGFRPIM1LCK
SCHEMBL7929769 0.89 PTGS2 (0.41) EGFRPIM1LCKPTGS2
SCHEMBL7933236 0.87 PTGS2 (0.40) LCKPTGS2
SCHEMBL7927149 0.85 PTGS2 (0.39) LCKPTGS2
SCHEMBL7921360 0.85 MAPK14 (0.36) LCKPTGS2
SCHEMBL7921414 0.83 MAPK14 (0.35) LCKPTGS2
SCHEMBL7933232 0.82 CSNK2A2 (0.46) EGFRPIM1LCK
SCHEMBL7930665 0.80 MAPK14 (0.36) LCKPTGS2
SCHEMBL7930637 0.80 EGFR (0.44) EGFRPIM1

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