SCHEMBL2312459

SCHEMBL2312459

OCCCCc1cc(CCCCO)c2c(c1)Sc1ccccc1N2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 11/20 0.45
MAPT P10636 7/20 0.45
GAA P10253 6/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
ALOX15 P16050 3/20 0.45
SNCA P37840 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
BCHE P06276 2/20 0.45
ACHE P22303 2/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
ALOX12 P18054 1/20 0.45
MAOA P21397 1/20 0.45
CNR1 P21554 1/20 0.45
PTGS1 P23219 1/20 0.45
SLC6A2 P23975 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL2311093 0.88 NOX1 (0.49) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2311120 0.83 NOX1 (0.50) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2311764 0.82 NOX1 (0.52) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2310455 0.82 NOX1 (0.52) NOX1MAPTGAAMEN1KMT2A
SCHEMBL3788839 0.81 NOX1 (0.50) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2308259 0.77 NOX1 (0.44) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2316262 0.74 BCHE (0.41) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2311782 0.73 NOX1 (0.47) NOX1MAPTGAAMEN1KMT2A
SCHEMBL2313210 0.73 NOX1 (0.55) NOX1MAPTGAAMEN1KMT2A
SCHEMBL9790945 0.72 NOX1 (0.46) NOX1MAPTGAAMEN1KMT2A

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-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed