SCHEMBL7973207

SCHEMBL7973207

O=C(CI)NCc1c(O)ccc2c1Oc1cc(O)ccc1C21OC(=O)c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 10/20 0.58
MAPT P10636 4/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
HTT P42858 2/20 0.58
RECQL P46063 2/20 0.58
BLM P54132 2/20 0.58
ACE2 Q9BYF1 2/20 0.58
PRMT1 Q99873 2/20 0.58
HPGD P15428 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMAD3 P84022 1/20 0.58
GNG2 P59768 1/20 0.47
GNB1 P62873 1/20 0.47
LMNA P02545 3/20 0.45
GPR55 Q9Y2T6 2/20 0.45
POLB P06746 1/20 0.45
ALOX12 P18054 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL3923505 0.91 FTO (0.58) FTOMAPTMEN1KMT2ATDP1
SCHEMBL7973463 0.90 GNG2 (0.58) FTOMAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL8712401 0.90 FTO (0.57) FTOMAPTMEN1KMT2ATDP1
SCHEMBL7973323 0.86 FTO (0.59) FTOMAPTMEN1KMT2ATDP1
SCHEMBL1831838 0.86 FTO (0.61) FTOMAPTMEN1KMT2ATDP1
SCHEMBL8714832 0.85 FTO (0.64) FTOMAPTMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL8718064 0.85 FTO (0.63) FTOMAPTMEN1KMT2ATDP1
SCHEMBL10863851 0.84 FTO (0.61) FTOMAPTMEN1KMT2ATDP1
SCHEMBL8417782 0.83 FTO (0.70) FTOMAPTMEN1KMT2ATDP1
SCHEMBL4838173 0.82 FTO (0.68) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6229055-B1 SYNTHESIS OF FLUORINATED RESORCINOL WHICH IS USEFUL IN THE PREPARATION OF FLUORINATED FLUORESCEIN AND RHODOL DYES SUITABLE FOR USE AS TRACERS, LABELS, OR INTERMEDIATES MOLECULAR PROBES, INC. 2001-05-08 US disclosed
US-6162931-A Fluorinated xanthene derivatives MOLECULAR PROBES, INC. (US) 2000-12-19 US disclosed
US-5420228-A PROBE FOR DETECTING THE INTRACELLULAR UPTAKE AND DISTRIBUTION OF A TALISOMYCIN UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1995-05-30 US disclosed
WO-1994002644-A9 IN SITU DETECTION OF NUCLEIC ACIDS USING 3SR AMPLIFICATION 1994-10-27 WO disclosed
WO-1994002640-A1 MULTI REPORTER-LABELED NUCLEIC ACID PROBES APROGENEX, INC. (US) 1994-02-03 WO disclosed
WO-1994002644-A1 IN SITU DETECTION OF NUCLEIC ACIDS USING 3SR AMPLIFICATION APROGENEX, INC. (US) 1994-02-03 WO disclosed