SCHEMBL8943967

SCHEMBL8943967

COc1cccc(N(c2ccc(Oc3ccc(N(c4cccc(OC)c4)c4cccc(OC)c4)cc3)cc2)c2cccc(OC)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.55
HSD17B2 P37059 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
PGR P06401 3/20 0.50
LTA4H P09960 1/20 0.50
MTNR1B P49286 9/20 0.44
MTNR1A P48039 8/20 0.44
ALOX15 P16050 1/20 0.44
ACHE P22303 1/20 0.44
ENPP2 Q13822 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 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
SCHEMBL8943783 0.96 LTA4H (0.57) HSD17B1HSD17B2SMN1; SMN2PGRLTA4H
SCHEMBL8943776 0.93 HSD17B1 (0.50) HSD17B1HSD17B2SMN1; SMN2PGRLTA4H
SCHEMBL8944301 0.93 HSD17B1 (0.51) HSD17B1HSD17B2SMN1; SMN2PGRLTA4H
SCHEMBL8944101 0.92 HSD17B2 (0.50) HSD17B1HSD17B2SMN1; SMN2LTA4HMTNR1B
SCHEMBL14163837 0.92 ACHE (0.50) HSD17B1HSD17B2MTNR1BMTNR1AALOX15
SCHEMBL8943710 0.92 ACHE (0.55) HSD17B1HSD17B2SMN1; SMN2PGRLTA4H
SCHEMBL13385303 0.89 CA4 (0.52) HSD17B1HSD17B2PGRLTA4HMTNR1B
SCHEMBL8820063 0.89 CA4 (0.50) HSD17B1HSD17B2PGRMTNR1BMTNR1A
SCHEMBL10066011 0.89 CA4 (0.50) HSD17B1HSD17B2PGRMTNR1BMTNR1A
SCHEMBL10065629 0.89 CA4 (0.50) HSD17B1HSD17B2PGRMTNR1BMTNR1A

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