SCHEMBL12909293

SCHEMBL12909293

Cc1ccc2c(=O)c3ccc(O[Si](C)(C)C(C)(C)C)cc3oc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.55
CA1 P00915 4/20 0.55
CA9 Q16790 4/20 0.55
MAOA P21397 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MAOB P27338 2/20 0.40
PREP P48147 1/20 0.40
ALDH1A1 P00352 5/20 0.39
HPGD P15428 4/20 0.39
KDM4E B2RXH2 3/20 0.39
CYP2C9 P11712 2/20 0.39
HSD17B10 Q99714 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGDR Q13258 1/20 0.39

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
SCHEMBL30043665 0.93 CA1 (0.61) CA12CA1CA9MAOANPC1
SCHEMBL840971 0.93 CA1 (0.61) CA12CA1CA9MAOANPC1
SCHEMBL8677800 0.86 MAOA (0.65) CA12CA1CA9MAOANPC1
SCHEMBL26768291 0.84 MAPT (0.54) CA12CA1CA9NPC1RAB9A
SCHEMBL9078491 0.79 NPC1 (0.71) CA1MAOANPC1RAB9AMAOB
SCHEMBL4712795 0.79 ALDH1A1 (0.64) CA12CA1CA9MAOANPC1
SCHEMBL8175559 0.78 ALDH1A1 (0.55) MAOANPC1RAB9AMAOBALDH1A1
SCHEMBL31124704 0.78 ALDH1A1 (0.55) MAOANPC1RAB9AMAOBALDH1A1
SCHEMBL1884168 0.77 CA12 (0.53) CA12CA1CA9MAOANPC1
SCHEMBL1885693 0.77 CA12 (0.53) CA12CA1CA9MAOANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152226-A1 OPTICAL SENSORS LUMIRADX UK LTD (GB) 2023-05-18 US disclosed
US-7868147-B2 substantially no fluorescent before the cleavage but highly fluorescent after the cleavage; traps a target substance such as an enzyme and emits fluorescence Nagano, Tetsuo (JP) 2011-01-11 US disclosed
US-20080014602-A1 Fluorescent Probe SEKISUI MEDICAL CO., LTD. (JP) 2008-01-17 US disclosed