SCHEMBL11592018

SCHEMBL11592018

COc1nc(Nc2ccc(C=Cc3ccc(Nc4nc(OC)nc(OC)n4)cc3)cc2)nc(OC)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.63
ALDH1A1 P00352 3/20 0.63
MAPT P10636 6/20 0.59
NPSR1 Q6W5P4 2/20 0.59
HTT P42858 2/20 0.59
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
GAA P10253 2/20 0.54
PDE4B Q07343 1/20 0.51
PDE4D Q08499 1/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPK1 P28482 3/20 0.50
TP53 P04637 1/20 0.50
ALOX15 P16050 1/20 0.50
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 1/20 0.43

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
SCHEMBL2203384 0.92 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL12732185 0.84 PDE4B (0.58) SMN1; SMN2ALDH1A1MAPTNPSR1CA1
SCHEMBL26812628 0.80 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL11432604 0.77 MAPT (0.55) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL13950336 0.76 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL14202653 0.76 PDE4B (0.52) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL14229501 0.76 PDE4B (0.52) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL12732158 0.76 CA1 (0.60) SMN1; SMN2ALDH1A1NPSR1HTTCA1
SCHEMBL14354708 0.76 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1MAPTNPSR1HTT
SCHEMBL19053365 0.73 SMN1; SMN2 (0.78) SMN1; SMN2ALDH1A1MAPTNPSR1HTT

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-4115124-A WITH POLYVINYLIMIDAZOLE EASTMAN KODAK COMPANY (US) 1978-09-19 US disclosed
US-4106941-A PHOTOSTABILITY EASTMAN KODAK COMPANY (US) 1978-08-15 US disclosed