SCHEMBL1305563

SCHEMBL1305563

O=C(O)N1CCC(C(=O)O)(c2nccnc2Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.39
TET3 O43151 4/20 0.39
FBXL19 Q6PCT2 4/20 0.39
CXXC5 Q7LFL8 4/20 0.39
KDM2B Q8NHM5 4/20 0.39
CXXC4 Q9H2H0 4/20 0.39
KDM2A Q9Y2K7 4/20 0.39
TET1 Q8NFU7 3/20 0.35
CYP3A4 P08684 3/20 0.33
CHRM2 P08172 1/20 0.32
CYP2D6 P10635 2/20 0.31
CYP2C9 P11712 6/20 0.31
CYP2C19 P33261 4/20 0.31
MEN1 O00255 2/20 0.31
TRPV1 Q8NER1 1/20 0.31
CYP1A2 P05177 1/20 0.30
USP2 O75604 2/20 0.30
CASP1 P29466 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TSHR P16473 2/20 0.30

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
SCHEMBL15547985 0.72 KMT2A (0.45) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL3931269 0.70 KMT2A (0.71) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL5136787 0.70 KMT2A (0.40) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL20510231 0.70 PKLR (0.40) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL30341801 0.70 PKLR (0.40) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL2331200 0.69 MALT1 (0.42) KMT2AMEN1TRPV1ALDH1A1
SCHEMBL1303878 0.69 POLB (0.49) KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL5732611 0.68 PKLR (0.51) KMT2ACHRM2MEN1TRPV1LMNA
SCHEMBL23779147 0.67 KMT2A (0.69) KMT2ATET3FBXL19CXXC5KDM2B
SCHEMBL31446209 0.66 AKR1C1 (0.34) KMT2ACYP2C19MEN1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329700-B2 Pyrazine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2012-12-11 US disclosed
US-20120277209-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2012-11-01 US disclosed
EP-2364308-B1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC (US) 2012-10-24 EP disclosed
US-8247418-B2 Pyrazine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2012-08-21 US disclosed
US-8053438-B2 Pyrazine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2011-11-08 US disclosed
US-20110160202-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2011-06-30 US disclosed
US-20110160182-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2011-06-30 US disclosed
US-20100137278-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-03 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-20110160182-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE10A, PDE12, PDE5A KMT2A 3603/4885TET3 2396/4885FBXL19 4187/4885
US-20100137278-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE10A, PDE12, PDE5A KMT2A 3603/4885TET3 2396/4885FBXL19 4187/4885
US-20110160202-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE10A, PDE12, PDE5A KMT2A 3603/4885TET3 2396/4885FBXL19 4187/4885
US-20120277209-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE10A, PDE12, PDE5A KMT2A 3681/4885TET3 2353/4885FBXL19 4609/4885

“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.