SCHEMBL14982912

SCHEMBL14982912

Oc1ccccc1/N=C/c1ccc(/C=N/c2ccccc2O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
MAPT P10636 8/20 0.56
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
LMNA P02545 6/20 0.56
GAA P10253 5/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
HTT P42858 4/20 0.56
HSD17B10 Q99714 2/20 0.56
TSHR P16473 1/20 0.56
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 7/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
ATM Q13315 1/20 0.53
NPC1 O15118 3/20 0.52
POLB P06746 4/20 0.51
TP53 P04637 2/20 0.51
RAB9A P51151 2/20 0.51

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
SCHEMBL4601928 0.94 CA2 (0.52) CA12CA2CA9MAPTMEN1
SCHEMBL4601929 0.94 CA2 (0.52) CA12CA2CA9MAPTMEN1
SCHEMBL29690204 0.94 CA2 (0.52) CA12CA2CA9MAPTMEN1
SCHEMBL14337533 0.93 CA2 (0.55) CA12CA2CA9MAPTMEN1
SCHEMBL1238795 0.93 CA2 (0.55) CA12CA2CA9MAPTMEN1
SCHEMBL2322410 0.93 CA2 (0.55) CA12CA2CA9MAPTMEN1
SCHEMBL30373259 0.93 CA2 (0.55) CA12CA2CA9MAPTMEN1
Lithium Ion SCHEMBL3400785 0.91 CA2 (0.53) CA12CA2CA9MAPTMEN1
SCHEMBL3365281 0.90 CA12 (0.49) CA12CA2CA9MAPTMEN1
SCHEMBL22103873 0.90 LMNA (0.58) CA12CA2CA9MAPTMEN1

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-20130137841-A1 SELF-ASSEMBLED MULTI-NUCLEAR CATALYST FOR OLEFIN POLYMERIZATION AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-05-30 US disclosed
US-20130137841-A1 SELF-ASSEMBLED MULTI-NUCLEAR CATALYST FOR OLEFIN POLYMERIZATION AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-05-30 US disclosed