SCHEMBL7933041

SCHEMBL7933041

CCCCOc1c(F)c2c(c(F)c1Nc1cccc(C#N)c1)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.38
PDE4A P27815 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
CXCR2 P25025 2/20 0.38
STK10 O94804 2/20 0.37
SLK Q9H2G2 2/20 0.37
CLK2 P49760 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
SYK P43405 1/20 0.37
TBXA2R P21731 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
CDC7 O00311 1/20 0.35
BRD4 O60885 1/20 0.35
P2RX1 P51575 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
SCHEMBL7930614 0.88 ADAMTS5 (0.40) CXCR2TBXA2R
SCHEMBL7929765 0.85 TBXA2R (0.37) PDE4BPDE4APDE4CPDE4DCXCR2
SCHEMBL7930657 0.85 ADAMTS5 (0.43) CXCR2
SCHEMBL7933074 0.84 TBXA2R (0.38) CXCR2TBXA2R
SCHEMBL7930671 0.82 KMT2A (0.43) CXCR2EGFRERBB2
SCHEMBL7930880 0.81 SMN1; SMN2 (0.47)
SCHEMBL7929768 0.81 SMN1; SMN2 (0.53)
SCHEMBL7928265 0.80 TSHR (0.41) CXCR2
SCHEMBL7930633 0.79 ELANE (0.38) CXCR2EGFR
SCHEMBL7930686 0.79 ELANE (0.38) EGFR

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