SCHEMBL7933074

SCHEMBL7933074

CCCCCCCCOc1c(F)c2c(c(F)c1Nc1ccc(C#N)cc1)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 2/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ADAMTS5 Q9UNA0 2/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MGLL Q99685 1/20 0.36
SRC P12931 1/20 0.36
CDC25B P30305 1/20 0.35
UNG P13051 2/20 0.35
CXCR2 P25025 1/20 0.34
STK4 Q13043 1/20 0.34
FAAH O00519 5/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL7930614 0.96 ADAMTS5 (0.40) TBXA2RKDM4EALDH1A1HPGDADAMTS5
SCHEMBL7933149 0.85 CDC25B (0.37) TBXA2RKDM4EALDH1A1HPGDADAMTS5
SCHEMBL7933041 0.84 PDE4B (0.38) TBXA2RCXCR2
SCHEMBL7933240 0.83 PKM (0.41) TBXA2RALDH1A1HPGDHTTMGLL
SCHEMBL7930019 0.82 ADAMTS5 (0.46) ADAMTS5CDC25BUNGFAAHNPC1
SCHEMBL7930660 0.82 STS (0.47) ALDH1A1HPGDNPC1RAB9A
SCHEMBL7929952 0.82 MAPT (0.49) KDM4EALDH1A1HPGDHTTNPC1
SCHEMBL7930657 0.82 ADAMTS5 (0.43) ALDH1A1ADAMTS5L3MBTL1CXCR2FAAH
SCHEMBL7921560 0.80 SMPD1 (0.37)
SCHEMBL7933227 0.80 CXCR2 (0.46) TBXA2RHTTCXCR2

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 5 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
EP-0833203-A1 Color filter grade photosensitive resin coloring composition, and color filter using the same NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-01 EP 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