SCHEMBL10277624

SCHEMBL10277624

CCOC(=O)c1ccc(O)c(O)c1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.50
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA7 P43166 4/20 0.50
CA9 Q16790 4/20 0.50
CA14 Q9ULX7 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 3/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 1/20 0.46
ALDH1A1 P00352 3/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TLR2 O60603 1/20 0.46
NSD2 O96028 1/20 0.46
PKM P14618 1/20 0.46
MPI P34949 1/20 0.46
GRK6 P43250 1/20 0.46

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
SCHEMBL21487204 0.85 SMN1; SMN2 (0.46) CA12CA1CA2CA7CA9
SCHEMBL27601395 0.82 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL8607087 0.80 SMN1; SMN2 (0.49) CA12CA1CA2CA7CA9
SCHEMBL297058 0.80 ALDH1A1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL27483315 0.79 SMN1; SMN2 (0.46) CA12CA1CA2CA7CA9
SCHEMBL639072 0.79 ALDH1A1 (0.61) CA12CA1CA2CA7CA9
SCHEMBL7435259 0.77 MAPK1 (0.40) SMN1; SMN2MAPTMEN1MAPK1KMT2A
SCHEMBL18285205 0.77 TSHR (0.56) CA12CA1CA2CA7CA9
SCHEMBL6656676 0.77 MEN1 (0.68) SMN1; SMN2MAPTMEN1MAPK1KMT2A
SCHEMBL7693503 0.77 SELL (0.57) CA12CA1CA2CA7CA9

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10570156-B2 Substituted imidazo[1,2-a]pyridines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2020-02-25 US disclosed
EP-3210984-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2019-06-19 EP disclosed
US-20180072759-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2018-03-15 US disclosed
US-20180072759-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2018-03-15 US disclosed
US-9856274-B2 Substituted pyrazolo[1,5-a]pyridines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2018-01-02 US disclosed
US-9856274-B2 Substituted pyrazolo[1,5-a]pyridines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2018-01-02 US disclosed
EP-3210984-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2017-08-30 EP disclosed
EP-3210984-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2017-08-30 EP disclosed
EP-2663565-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2017-03-15 EP disclosed
EP-2663565-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2017-03-15 EP disclosed
US-20140288062-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2014-09-25 US disclosed
US-8765760-B2 [1,2,4] triazol [1,5-a] pyrazines useful as inhibitors of phosphodiesterases SUNOVION PHARMACEUTICALS, INC. (US) 2014-07-01 US disclosed
US-8765760-B2 [1,2,4] triazol [1,5-a] pyrazines useful as inhibitors of phosphodiesterases SUNOVION PHARMACEUTICALS, INC. (US) 2014-07-01 US disclosed
US-8765760-B2 [1,2,4] triazol [1,5-a] pyrazines useful as inhibitors of phosphodiesterases SUNOVION PHARMACEUTICALS, INC. (US) 2014-07-01 US disclosed
EP-2663565-A2 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2013-11-20 EP disclosed
WO-2012096929-A2 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-07-19 WO disclosed
WO-2012096929-A2 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-07-19 WO disclosed
US-20120178748-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-07-12 US disclosed
US-20120178748-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-07-12 US disclosed
US-20120178748-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-07-12 US 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 (4 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-20120178748-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN CA12 4449/4885CA1 4139/4885CA2 4630/4885
US-20180072759-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN CA12 4449/4885CA1 4139/4885CA2 4630/4885
US-10570156-B2 Substituted imidazo[1,2-a]pyridines as PDE-10 inhibitors PDE3A, PDE2A, PDE5A CA12 4199/4885CA1 3425/4885CA2 1552/4885
US-20140288062-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN CA12 4449/4885CA1 4139/4885CA2 4630/4885

“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.