SCHEMBL8943982

SCHEMBL8943982

COc1ccc(Nc2cccc(Oc3ccc(C(c4ccc(Oc5cccc(Nc6ccc(OC)cc6)c5Nc5ccc(OC)cc5)cc4)(C(F)(F)F)C(F)(F)F)cc3)c2Nc2ccc(OC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
RAB9A P51151 6/20 0.43
MAPT P10636 7/20 0.41
MAPK1 P28482 4/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.41
THRB P10828 2/20 0.41
RECQL P46063 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 1/20 0.41
MMP14 P50281 1/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ACP1 P24666 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
NPC1 O15118 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GAK O14976 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
SCHEMBL8943622 0.87 ALDH1A1 (0.56) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8943996 0.86 ALDH1A1 (0.47) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8944040 0.86 ALDH1A1 (0.54) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8943910 0.85 CACNA1B (0.41)
SCHEMBL8943619 0.83 ALDH1A1 (0.51) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8944008 0.82 FAAH (0.40)
SCHEMBL8943962 0.80 ALDH1A1 (0.51) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8943655 0.76 MAPT (0.45) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8944011 0.75 MAPT (0.39) ALDH1A1RAB9AMAPTMAPK1KDM4E
SCHEMBL8944203 0.74 GAA (0.44) ALDH1A1RAB9AMAPTKDM4EGAA

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