SCHEMBL7928384

SCHEMBL7928384

CCCCNc1c(Nc2ccc(C(=O)OCC)cc2)c(OCCCC)c2c(c1OCCCC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
TSHR P16473 2/20 0.45
HPGD P15428 5/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 2/20 0.44
THRB P10828 2/20 0.44
APAF1 O14727 1/20 0.44
MITF O75030 1/20 0.44
NR4A1 P22736 1/20 0.44
HTT P42858 1/20 0.44
SMAD3 P84022 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
LMNA P02545 3/20 0.43
CYP1A2 P05177 3/20 0.43
SCN5A Q14524 2/20 0.43
MAPK1 P28482 2/20 0.43
MAOA P21397 1/20 0.43
CNR1 P21554 1/20 0.43

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
SCHEMBL7927091 0.89 SMN1; SMN2 (0.52) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7921187 0.86 MAPT (0.48) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7928410 0.85 MAPT (0.47) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7921278 0.85 ADAMTS5 (0.42) TSHRHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL7929778 0.84 MAPT (0.51) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7927465 0.82 MGLL (0.40) HPGDKDM4ECA1CA2CA12
SCHEMBL7927081 0.82 MAPT (0.42) MAPTTSHRMEN1KMT2ASMN1; SMN2
SCHEMBL7929952 0.81 MAPT (0.49) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7921067 0.80 MAPT (0.46) MAPTTSHRHPGDMEN1KMT2A
SCHEMBL7929927 0.79 SMN1; SMN2 (0.55) MAPTTSHRHPGDMEN1KMT2A

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