SCHEMBL562216

SCHEMBL562216

COc1ccc(C=NCc2ccc(OC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.52
CA12 O43570 2/20 0.52
CA9 Q16790 2/20 0.52
CA1 P00915 1/20 0.52
ERN1 O75460 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 3/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 1/20 0.50
MIF P14174 1/20 0.50
G6PC1 P35575 1/20 0.49
KMT2A Q03164 1/20 0.47
GRIN2D O15399 2/20 0.47
GRIN3B O60391 2/20 0.47
GRIN1 Q05586 2/20 0.47
GRIN2A Q12879 2/20 0.47
GRIN2B Q13224 2/20 0.47
GRIN2C Q14957 2/20 0.47
GRIN3A Q8TCU5 2/20 0.47

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
SCHEMBL562215 1.00 CA2 (0.52) CA2CA12CA9CA1ERN1
SCHEMBL19233526 0.92 NFE2L2 (0.56) CA2CA12CA9CA1ERN1
SCHEMBL8544003 0.91 CA2 (0.54) CA2CA12CA9CA1ERN1
SCHEMBL10322462 0.91 CA2 (0.54) CA2CA12CA9CA1ERN1
SCHEMBL11984337 0.91 G6PC1 (0.60) CA2CA12CA9CA1ERN1
SCHEMBL8543996 0.91 G6PC1 (0.60) CA2CA12CA9CA1ERN1
SCHEMBL4006483 0.90 S100B (0.62) CA2CA12CA9CA1ERN1
SCHEMBL4006482 0.90 S100B (0.62) CA2CA12CA9CA1ERN1
SCHEMBL24343474 0.89 ALDH1A1 (0.51) CA2CA12CA9CA1ERN1
SCHEMBL6124203 0.89 G6PC1 (0.51) CA2CA12CA9CA1ERN1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112409205-B Application of carbon nanocages in catalyzing aromatic imino compounds to perform oxidative coupling reaction 南京大学 2021-12-17 CN disclosed
CN-112409205-A Application of carbon nanocages in catalyzing aromatic imino compounds to perform oxidative coupling reaction 南京大学 2021-02-26 CN disclosed
EP-1953158-B1 BICYCLIC CINNAMIDE COMPOUND EISAI R&D MAN CO LTD (JP) 2012-09-12 EP disclosed
US-8143270-B2 2-amino 1H-in-imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-27 US disclosed
US-20120035209-A1 Hydroxy Substituted 1H-Imidazopyridines and Methods PFIZER INC. (US) 2012-02-09 US disclosed
US-8048878-B2 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-11-01 US disclosed
US-20100152230-A1 HYDROXY SUBSTITUTED 1H-IMIDAZOPYRIDINES AND METHODS PFIZER INC. 2010-06-17 US disclosed
EP-1784180-A4 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-07-22 EP disclosed
US-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND KIMURA TEIJI 2009-07-16 US disclosed
US-20090023720-A1 2-Amino 1H-Imidazo Ring Systems and Methods 3M INNOVATIVE PROPERTIES COMPANY 2009-01-22 US disclosed
EP-1953158-A1 BICYCLIC CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117839-A1 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 US disclosed
EP-1784180-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-16 EP disclosed
WO-2006029115-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100152230-A1 HYDROXY SUBSTITUTED 1H-IMIDAZOPYRIDINES AND METHODS IL4, IL2, IL4I1 CA2 4046/4885CA12 4580/4885CA9 4687/4885
US-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND APP, BACE1, PSEN1 CA2 2634/4885CA12 3686/4885CA9 4129/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 CA2 2634/4885CA12 3686/4885CA9 4129/4885
US-20090023720-A1 2-Amino 1H-Imidazo Ring Systems and Methods IL2, IL2RA, IL4I1 CA2 3114/4885CA12 4341/4885CA9 4761/4885
US-20120035209-A1 Hydroxy Substituted 1H-Imidazopyridines and Methods IL2, IL4, IL4I1 CA2 4075/4885CA12 4584/4885CA9 4694/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.