SCHEMBL10288447

SCHEMBL10288447

CCNC(=O)C1CCN(c2cccnc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.43
P2RX7 Q99572 2/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
DRD2 P14416 2/20 0.41
USP30 Q70CQ3 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
GAA P10253 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
ELANE P08246 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DRD3 P35462 1/20 0.38

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
SCHEMBL14817547 0.86 HDAC1 (0.45) HDAC1P2RX7FNTAFNTBDRD2
SCHEMBL13620013 0.85 USP30 (0.54) HDAC1ALDH1A1TSHRUSP30ROCK2
SCHEMBL10201959 0.83 HDAC1 (0.43) HDAC1P2RX7ALDH1A1FNTAFNTB
SCHEMBL10224501 0.82 HDAC1 (0.45) HDAC1ALDH1A1FNTAFNTBDRD2
SCHEMBL307940 0.81 HDAC1 (0.45) HDAC1ALDH1A1FNTAFNTBDRD2
SCHEMBL308318 0.81 HDAC1 (0.46) HDAC1FNTAFNTBDRD2USP30
SCHEMBL16281036 0.78 MET (0.45) HDAC1TSHRUSP30SMN1; SMN2
SCHEMBL2605830 0.73 FPR2 (0.47) P2RX7ALDH1A1USP30ROCK2ROCK1
SCHEMBL7614501 0.71 L3MBTL1 (0.47) HDAC1FNTAFNTBDRD2PDE4A
SCHEMBL7614509 0.71 L3MBTL1 (0.47) HDAC1FNTAFNTBDRD2PDE4A

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
EP-2426108-B1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC (CA) 2016-08-10 EP disclosed
US-9018378-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2015-04-28 US disclosed
US-8907091-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 US disclosed
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 HDAC1 1373/4885P2RX7 1829/4885ALDH1A1 1649/4885
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 HDAC1 3154/4885P2RX7 2486/4885ALDH1A1 3152/4885
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET HDAC1 2577/4885P2RX7 2226/4885ALDH1A1 3139/4885
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity ERBB2, ABL1, FLT1 HDAC1 3131/4885P2RX7 1308/4885ALDH1A1 4061/4885

“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.