SCHEMBL10033987

SCHEMBL10033987

CCCN1C/C(=C\c2cccc(OC)c2OC)C(=O)/C(=C/c2cccc(OC)c2OC)C1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.57
MAOB P27338 2/20 0.55
ALDH1A1 P00352 4/20 0.49
MAPT P10636 4/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
ACHE P22303 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
ADAM17 P78536 1/20 0.46
GAA P10253 1/20 0.46
PAX8 Q06710 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PDE4B Q07343 1/20 0.44

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
SCHEMBL17899554 0.90 MAOB (0.57) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL17899557 0.85 NFE2L2 (0.77) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL25842383 0.84 MAOB (0.55) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL25842368 0.80 NFE2L2 (0.68) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL17899577 0.80 KMT2A (0.64) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL17899539 0.80 NFE2L2 (0.56) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL30884869 0.78 NFE2L2 (0.73) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL27003029 0.78 NFE2L2 (0.73) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL29205210 0.78 NFE2L2 (0.73) NFE2L2MAOBALDH1A1MAPTPOLB
SCHEMBL17899497 0.78 ACHE (0.61) NFE2L2MAOBALDH1A1MAPTKMT2A

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-20120157474-A1 Methods of Identifying and Using General or Alternative Splicing Inhibitors THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-06-21 US disclosed