SCHEMBL7933240

SCHEMBL7933240

CCCCCCCCOc1c(F)c2c(c(F)c1Nc1ccc([N+](=O)[O-])cc1)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
MAPT P10636 6/20 0.40
LMNA P02545 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALOX12 P18054 1/20 0.40
CYP19A1 P11511 4/20 0.39
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
HIF1A Q16665 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
XBP1 P17861 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MGLL Q99685 1/20 0.38
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 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
SCHEMBL7929794 0.96 PKM (0.44) PKMMAPTLMNAMEN1KMT2A
SCHEMBL7921420 0.85 CYP19A1 (0.41) PKMMAPTLMNAMEN1KMT2A
SCHEMBL7930671 0.85 KMT2A (0.43) MAPTLMNAMEN1KMT2AALOX12
SCHEMBL7933074 0.83 TBXA2R (0.38) MGLLHTTALDH1A1HPGDCXCR2
SCHEMBL7930660 0.82 STS (0.47) PKMMAPTLMNAMEN1KMT2A
SCHEMBL7929952 0.82 MAPT (0.49) MAPTMEN1KMT2ATSHRHTT
SCHEMBL7928581 0.81 CSNK2A2 (0.40) MAPTKMT2ACYP3A4TSHRHIF1A
SCHEMBL7930657 0.81 ADAMTS5 (0.43) MAPTLMNAMEN1KMT2AMAPK1
SCHEMBL7927158 0.81 CYP3A4 (0.51) MAPTMEN1KMT2AALOX12CYP3A4
SCHEMBL7927081 0.80 MAPT (0.42) PKMMAPTLMNAMEN1KMT2A

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-5968688-A RESINS AND DYES FOR COLOR FILTERS NIPPON SHOKUBAI CO., LTD. (JP) 1999-10-19 US 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