SCHEMBL7206703

SCHEMBL7206703

O=C(O)c1ccc2c(c1)Oc1ccccc1N2.O=C1CC=CN(O)C1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.55
HTR2B P41595 2/20 0.46
HTR7 P34969 1/20 0.38
KDM4E B2RXH2 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
TTR P02766 1/20 0.33
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL2513769 0.81 ALOX5 (0.82) ALOX5HTR2BHTR7KDM4ETDP1
SCHEMBL28406723 0.74 ALOX5 (0.67) ALOX5HTR2BHTR7KDM4EGAA
SCHEMBL2483714 0.73 ALOX5 (1.00) ALOX5HTR2BHTR7TDP1GAA
SCHEMBL30812968 0.73 ALOX5 (1.00) ALOX5HTR2BHTR7TDP1GAA
SCHEMBL28403621 0.71 ALOX5 (0.79) ALOX5HTR2BHTR7KDM4EGAA
Phenoxazine SCHEMBL6270610 0.66 ALOX5 (0.77) ALOX5HTR2BHTR7TDP1LMNA
SCHEMBL26115655 0.66 ALOX5 (0.84) ALOX5HTR2BHTR7MEN1KMT2A
SCHEMBL28400911 0.65 ALOX5 (0.83) ALOX5HTR2BHTR7KDM4ETDP1
Bicarbonate SCHEMBL6271245 0.64 ALOX5 (0.56) ALOX5HTR2BHTR7KDM4ETDP1
SCHEMBL5115778 0.64 HTR2B (0.62) ALOX5HTR2BHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610686-B1 Administering onto corneal tissue topical opthalmic drug comprising 1-hydroxy-5-oxo-5H-pyrido-phenoxazin-3-carboxylic acid (pirenoxine) or pharmaceutically acceptable salt for protection of corneal tissue in photokeratectomy intervention AUSIMONT S.P.A. (IT) 2003-08-26 US claimed