SCHEMBL4422968

SCHEMBL4422968

COc1ccc(N(c2cc[c]cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA12 O43570 1/20 0.48
CA14 Q9ULX7 1/20 0.48
SLC2A1 P11166 1/20 0.42
ACHE P22303 1/20 0.41
ENPP2 Q13822 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
MAPK1 P28482 2/20 0.39
APP P05067 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP3A4 P08684 2/20 0.38
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL6152700 0.92 CA4 (0.46) CA1CA2CA7CA9CA12
SCHEMBL28429576 0.90 ESR2 (0.45) CA1CA2CA7CA9CA12
SCHEMBL1573622 0.86 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL6233100 0.86 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL6553696 0.85 CA12 (0.46) CA1CA2CA7CA9CA12
SCHEMBL10057879 0.79 ESR2 (0.56) CA1CA2CA7CA9CA12
SCHEMBL10057657 0.79 ESR2 (0.56) CA1CA2CA7CA9CA12
SCHEMBL14163846 0.79 CA1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL22382223 0.79 LTA4H (0.58) CA1CA2CA7CA9CA12
SCHEMBL10057769 0.79 ESR2 (0.56) CA1CA2CA7CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110272350-A A kind of fluorescent chemicals and the preparation method and application thereof driving viscosity measurements for tertiary oil recovery oil 华南理工大学 2019-09-24 CN claimed
US-11015061-B2 Phthalocyanine-based compound and uses of same YAMAMOTO CHEMICALS, INC. (JP) 2021-05-25 US disclosed
CN-110272350-B Fluorescent compound for tertiary oil recovery oil-drive viscosity detection and preparation method and application thereof 华南理工大学 2021-05-14 CN disclosed
US-20200032066-A1 PHTHALOCYANINE-BASED COMPOUND AND USES OF SAME YAMAMOTO CHEMICALS, INC. (JP) 2020-01-30 US disclosed
CN-110272350-A A kind of fluorescent chemicals and the preparation method and application thereof driving viscosity measurements for tertiary oil recovery oil 华南理工大学 2019-09-24 CN disclosed
US-20090323747-A1 ORGANIC SOLID-STATE DYE LASER JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-12-31 US disclosed
US-20050179013-A1 Hyperpolarizable organic chromophores UNIVERSITY OF WASHINGTON 2005-08-18 US disclosed