SCHEMBL7869025

SCHEMBL7869025

OB(O)C1c2ccccc2-c2cccc(-c3nc4ccccc4s3)c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.48
RAB9A P51151 8/20 0.48
NPC1 O15118 7/20 0.48
MAPT P10636 7/20 0.48
ALDH1A1 P00352 6/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
GAA P10253 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NPSR1 Q6W5P4 1/20 0.45
POLB P06746 3/20 0.44
HSD17B10 Q99714 3/20 0.42
APP P05067 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP1 P29466 1/20 0.42
SNCA P37840 1/20 0.42
CASP7 P55210 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
SCHEMBL231307 0.73 KDM4E (0.75) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL2998404 0.71 KDM4E (0.63) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL12854008 0.71 KDM4E (0.72) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL30132720 0.69 KDM4E (0.73) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL196475 0.69 KDM4E (0.73) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL30689066 0.69 KDM4E (0.64) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL2225061 0.69 KDM4E (0.64) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL5974815 0.68 RAB9A (0.67) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL29558566 0.68 RAB9A (0.67) KDM4ERAB9ANPC1MAPTALDH1A1
SCHEMBL1549970 0.67 KDM4E (0.71) KDM4ERAB9ANPC1MAPTALDH1A1

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-6300502-B1 Multi-armed chromophores with very large two-photon absorption cross-sections THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2001-10-09 US disclosed
US-6100405-A Benzothiazole-containing two-photon chromophores exhibiting strong frequency upconversion THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2000-08-08 US disclosed