SCHEMBL8944225

SCHEMBL8944225

COc1ccc(N(c2ccc(OC)cc2)c2ccc(Oc3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.58
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA12 O43570 1/20 0.55
CA14 Q9ULX7 1/20 0.55
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PGR P06401 2/20 0.47
SLC2A1 P11166 1/20 0.47
PARP10 Q53GL7 1/20 0.47
ACHE P22303 1/20 0.46
ENPP2 Q13822 1/20 0.44
TDP1 Q9NUW8 3/20 0.44
MAPK1 P28482 2/20 0.44
APP P05067 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL22382223 1.00 LTA4H (0.58) LTA4HCA1CA2CA7CA9
SCHEMBL23866714 0.93 LTA4H (0.52) LTA4HCA1CA2CA7CA9
SCHEMBL1573622 0.92 CA1 (0.65) LTA4HCA1CA2CA7CA9
SCHEMBL6233100 0.92 CA1 (0.65) LTA4HCA1CA2CA7CA9
SCHEMBL8943612 0.91 LTA4H (0.68) LTA4HCA1CA2CA7CA9
SCHEMBL8944066 0.91 LTA4H (0.75) LTA4HCA1CA2CA7CA9
SCHEMBL8943781 0.91 ACHE (0.62) LTA4HCA1CA2CA7CA9
SCHEMBL8943843 0.91 LTA4H (0.75) LTA4HCA1CA2CA7CA9
SCHEMBL8943940 0.89 LTA4H (0.72) LTA4HCA1CA2CA7CA9
SCHEMBL18904062 0.86 LTA4H (0.61) LTA4HALDH1A1MEN1KMT2APGR

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-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed