SCHEMBL7930649

SCHEMBL7930649

COc1cccc(Nc2c(F)c3c(c(F)c2Nc2cccc(OC)c2)C(=O)c2c(O)ccc(O)c2C3=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
POLB P06746 1/20 0.58
TSHR P16473 3/20 0.56
GFER P55789 1/20 0.56
RAPGEF4 Q8WZA2 1/20 0.49
GAA P10253 1/20 0.47
MTNR1B P49286 3/20 0.46
MTNR1A P48039 2/20 0.46
EGFR P00533 1/20 0.46
PIM1 P11309 1/20 0.46
RAB9A P51151 2/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
SYK P43405 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
PDE4B Q07343 1/20 0.44
AURKA O14965 1/20 0.44
STK10 O94804 1/20 0.44

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
SCHEMBL7927100 0.95 MEN1 (0.57) MEN1KMT2APOLBTSHRGFER
SCHEMBL7921288 0.83 MAPT (0.46) MEN1KMT2APOLBGAAEGFR
SCHEMBL7928231 0.79 MEN1 (0.53) MEN1KMT2APOLBTSHRGAA
SCHEMBL7921197 0.78 MAPT (0.43) MEN1KMT2APOLBGAAEGFR
SCHEMBL7930883 0.78 CXCR2 (0.47) MEN1KMT2APOLBTSHRRAB9A
SCHEMBL7928349 0.76 EGFR (0.52) MEN1KMT2ATSHRGAAEGFR
SCHEMBL7921294 0.76 CDC25B (0.56) KMT2APOLBTSHRRAB9AMAPT
SCHEMBL7933112 0.76 EGFR (0.51) MEN1KMT2APOLBGAAEGFR
SCHEMBL7930620 0.75 HDAC3 (0.45) MEN1KMT2APOLBGAAMAPT
SCHEMBL7930030 0.74 CA12 (0.40) MEN1KMT2APOLBTSHRGFER

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