SCHEMBL7928353

SCHEMBL7928353

CCCCCCCCOc1c(Nc2c(C)cccc2C)c(Nc2c(C)cccc2C)c(F)c2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.35
CTSG P08311 2/20 0.35
CNR1 P21554 5/20 0.35
CNR2 P34972 5/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
SMPD1 P17405 1/20 0.34
ESR1 P03372 2/20 0.33
FAAH O00519 1/20 0.33

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
SCHEMBL7929756 0.93 MAPK14 (0.35) ELANECTSGCNR1CNR2KDM4E
SCHEMBL7929873 0.93 ELANE (0.38) ELANECTSGCNR1CNR2KDM4E
SCHEMBL7933317 0.92 CNR1 (0.36) ELANECNR1CNR2KDM4ESMPD1
SCHEMBL7929795 0.92 EGFR (0.39) ELANECNR1CNR2
SCHEMBL7933215 0.90 FAAH (0.38) ELANECTSGCNR1CNR2SMPD1
SCHEMBL7929802 0.90 TSHR (0.38) KDM4EALDH1A1THRB
SCHEMBL7930360 0.89 ELANE (0.37) ELANECTSGCNR1CNR2SMPD1
SCHEMBL7930665 0.89 MAPK14 (0.36) ELANEKDM4EESR1
SCHEMBL7929762 0.88 SMPD1 (0.35) ELANECTSGTHRATHRBSMPD1
SCHEMBL7928316 0.88 ELANE (0.34) ELANECTSGCNR1CNR2SMPD1

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