SCHEMBL7928349

SCHEMBL7928349

COc1cccc(C)c1Nc1c(F)c2c(c(F)c1Nc1c(C)cccc1OC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.52
PIM1 P11309 1/20 0.52
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ELANE P08246 1/20 0.42
TAAR1 Q96RJ0 1/20 0.40
ATM Q13315 1/20 0.39
CXCR2 P25025 1/20 0.38
P4HB P07237 1/20 0.38
CYP3A4 P08684 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 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
SCHEMBL7921267 0.87 CXCR2 (0.44) EGFRPIM1MEN1KMT2AELANE
SCHEMBL7928407 0.86 EGFR (0.40) EGFRPIM1MEN1KMT2AELANE
SCHEMBL7933104 0.86 EGFR (0.40) EGFRPIM1MEN1KMT2ACXCR2
SCHEMBL6651932 0.85 MAPT (0.47) EGFRPIM1MEN1KMT2AELANE
SCHEMBL29502784 0.85 MAPT (0.47) EGFRPIM1MEN1KMT2AELANE
SCHEMBL7929795 0.85 EGFR (0.39) EGFRPIM1ELANE
SCHEMBL7927337 0.84 EGFR (0.46) EGFRPIM1MEN1KMT2AELANE
SCHEMBL7929777 0.82 CXCR2 (0.42) EGFRPIM1MEN1KMT2AELANE
SCHEMBL7929769 0.81 PTGS2 (0.41) EGFRPIM1ELANECXCR2SRC
SCHEMBL7933112 0.81 EGFR (0.51) EGFRPIM1MEN1KMT2AATM

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