SCHEMBL7927337

SCHEMBL7927337

COc1c(F)c2c(c(F)c1Nc1c(C)cccc1C)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.46
PIM1 P11309 1/20 0.46
DHODH Q02127 1/20 0.41
CYP2C9 P11712 1/20 0.38
CXCR2 P25025 1/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 3/20 0.37
ELANE P08246 3/20 0.37
CTSG P08311 1/20 0.37
MAOA P21397 3/20 0.36
MAPT P10636 3/20 0.36
IDO1 P14902 1/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL7921206 0.92 EGFR (0.41) EGFRPIM1LCK
SCHEMBL7933232 0.88 CSNK2A2 (0.46) EGFRPIM1CYP2C9CXCR2MEN1
SCHEMBL7921267 0.87 CXCR2 (0.44) EGFRPIM1DHODHCXCR2MEN1
SCHEMBL7921280 0.86 EGFR (0.45) EGFRPIM1MEN1KMT2AMAOA
SCHEMBL7929777 0.85 CXCR2 (0.42) EGFRPIM1DHODHCXCR2MEN1
SCHEMBL7930637 0.85 EGFR (0.44) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL7928349 0.84 EGFR (0.52) EGFRPIM1DHODHCXCR2MEN1
SCHEMBL7930633 0.83 ELANE (0.38) EGFRPIM1DHODHCXCR2MEN1
SCHEMBL7921426 0.83 PIM1 (0.40) EGFRPIM1MEN1KMT2AALDH1A1
SCHEMBL7929873 0.81 ELANE (0.38) EGFRPIM1DHODHALDH1A1ELANE

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