SCHEMBL7740798

SCHEMBL7740798

O=C1OC2(c3ccc(O)cc3Oc3cc(OO)ccc32)c2ccccc21

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 8/20 0.81
MAPT P10636 4/20 0.81
MEN1 O00255 4/20 0.81
KMT2A Q03164 4/20 0.81
TDP1 Q9NUW8 3/20 0.81
HTT P42858 2/20 0.81
HPGD P15428 2/20 0.81
RECQL P46063 2/20 0.81
BLM P54132 2/20 0.81
PRMT1 Q99873 2/20 0.81
ACE2 Q9BYF1 2/20 0.81
CYP2C19 P33261 1/20 0.81
SMAD3 P84022 1/20 0.81
LMNA P02545 3/20 0.65
ALDH1A1 P00352 3/20 0.65
USP2 O75604 2/20 0.65
CYP3A4 P08684 2/20 0.63
GPR55 Q9Y2T6 2/20 0.57
ALOX12 P18054 2/20 0.57
POLB P06746 1/20 0.57

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
SCHEMBL30270934 0.92 FTO (0.79) FTOMAPTMEN1KMT2ATDP1
SCHEMBL4663321 0.91 FTO (0.82) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL29388667 0.90 FTO (1.00) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL29371199 0.90 FTO (1.00) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL3645090 0.90 FTO (1.00) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL30272223 0.90 FTO (1.00) FTOMAPTMEN1KMT2ATDP1
Fluorescein SCHEMBL16533 0.90 FTO (1.00) FTOMAPTMEN1KMT2ATDP1
SCHEMBL29469741 0.89 FTO (0.79) FTOMAPTMEN1KMT2ATDP1
SCHEMBL7210796 0.89 FTO (0.79) FTOMAPTMEN1KMT2ATDP1
SCHEMBL6622095 0.89 FTO (0.79) FTOMAPTMEN1KMT2ATDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420181-B1 DETECTING PREFERENTIAL PARTICLE IN SOLUTION; OBTAIN SOLUTION CONTAINING PARTICLE, MIX WITH SOLVENT, INSERT INTO TUBE, INCUBATE WITH CHROMOGENIC DETECTION INDICATOR, MONITOR SAMPLE FOR SIGNAL THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2002-07-16 US disclosed
EP-0320086-B2 Method for detection and quantitative analysis for water treatment chemicals UNILEVER NV (NL) 1999-03-03 EP disclosed