SCHEMBL6738753

SCHEMBL6738753

OC1C=CC=C(Cc2ccccn2)C1O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
HRH4 Q9H3N8 1/20 0.36
HRH1 P35367 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
ASIC3 Q9UHC3 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
MAPT P10636 1/20 0.35
LIN28A Q9H9Z2 1/20 0.35
FDPS P14324 1/20 0.34
PTPRA P18433 1/20 0.34

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
SCHEMBL6744628 0.72 KDM4E (0.43) L3MBTL1SMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL41191 0.69 L3MBTL1 (0.59) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
SCHEMBL29830938 0.69 L3MBTL1 (0.59) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
SCHEMBL29715188 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL6176560 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
SCHEMBL4938207 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
Bromide SCHEMBL6114859 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
SCHEMBL4938201 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
Hydrochloric Acid SCHEMBL10884973 0.67 L3MBTL1 (0.57) L3MBTL1HRH3HRH4HRH1SMN1; SMN2
SCHEMBL580640 0.66 L3MBTL1 (0.52) L3MBTL1HRH3HRH4HRH1SMN1; SMN2

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-20040086983-A1 Method for producing a heterocyclic compound and an aromatic carboxylic acid having one or more hydroxyl groups, and modified aromatic ring dioxygenase MARINE BIOTHECHNOLOGY INSTITUTE., LTD. (JP) 2004-05-06 US disclosed