SCHEMBL2795349

SCHEMBL2795349

NC(CC(=O)NCc1ccc(F)cc1)c1ccc(C(=O)Nc2ccncc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 10/20 0.60
L3MBTL1 Q9Y468 2/20 0.54
ROCK2 O75116 3/20 0.52
ROCK1 Q13464 2/20 0.52
CYP3A4 P08684 1/20 0.48
MAPK14 Q16539 1/20 0.48
HDAC1 Q13547 1/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 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
SCHEMBL13230434 1.00 NAMPT (0.60) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
SCHEMBL13230439 1.00 NAMPT (0.60) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
Hydrochloric Acid SCHEMBL2791710 0.99 NAMPT (0.59) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
Hydrochloric Acid SCHEMBL2790960 0.99 NAMPT (0.59) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
Hydrochloric Acid SCHEMBL27719878 0.99 NAMPT (0.59) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
SCHEMBL2794103 0.92 ROCK2 (0.57) NAMPTL3MBTL1ROCK2ROCK1KDM4E
SCHEMBL2792952 0.91 HIF1A (0.53) NAMPTL3MBTL1ROCK2ROCK1KDM4E
SCHEMBL2793989 0.90 NAMPT (0.55) NAMPTL3MBTL1ROCK2ROCK1KDM4E
SCHEMBL2792068 0.89 NAMPT (0.60) NAMPTL3MBTL1ROCK2ROCK1CYP3A4
SCHEMBL2794930 0.89 NAMPT (0.58) NAMPTL3MBTL1ROCK2ROCK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168102-A9 Amide Derivatives as Kinase Inhibitors DEVGEN NV (BE) 2010-07-01 US disclosed
US-20090118283-A1 Amide Derivatives as Kinase Inhibitors DEVGEN NV (BE) 2009-05-07 US disclosed
CN-101296904-A Amide derivatives as kinase inhibitors DEVGEN NV (BE) 2008-10-29 CN 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 (2 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-20100168102-A9 Amide Derivatives as Kinase Inhibitors MAP3K1, CDK1, CDK2 NAMPT 1420/4885L3MBTL1 2827/4885ROCK2 528/4885
US-20090118283-A1 Amide Derivatives as Kinase Inhibitors MAP3K1, CDK1, CDK2 NAMPT 1420/4885L3MBTL1 2827/4885ROCK2 528/4885

“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.