SCHEMBL6754479

SCHEMBL6754479

CCOC(=O)c1ccc2cc(-c3ccc(OC)cc3)ccn2c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.45
▸ KDM4E B2RXH2 7/20 0.45
▸ GAA P10253 6/20 0.45
▸ HPGD P15428 5/20 0.45
▸ GLA P06280 3/20 0.45
▸ FNTA P49354 1/20 0.43
▸ FNTB P49356 1/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ POLB P06746 3/20 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
SCHEMBL6753476 0.84 SMN1; SMN2 (0.47) ALDH1A1KDM4EGAAHPGDL3MBTL1
SCHEMBL10362962 0.80 KDM4E (0.62) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL10362966 0.79 KDM4E (0.46) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL6754552 0.79 KDM4E (0.51) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL10362803 0.79 CA12 (0.54) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL25223019 0.78 KDM4E (0.50) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL6755336 0.78 KDM4E (0.50) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL3994731 0.77 GAA (0.52) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL6754531 0.76 KDM4E (0.46) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL6752153 0.75 KDM4E (0.46) ALDH1A1KDM4EGAAHPGDGLA

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-6706528-B2 DETECTING MAGNESIUM ION WITH A CARBOXY-QUINOLIZINE COMPOUND TO FORM A COMPLEX AND DETECTING FLUORESCENCE IN SAID COMPLEX; FOR DIAGNOSIS OF CARDIOVASCULAR DISEASES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2004-03-16 — — US disclosed
US-20020031834-A1 Fluorescent magnesium indicators THE GOVERNMENT OF THE UNITED STATES 2002-03-14 — — US disclosed
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