SCHEMBL3504281

SCHEMBL3504281

NC(C(=O)NCCn1ccnc1)c1ccc(C(=O)Nc2ccncc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.51
ROCK1 Q13464 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51
KDM4E B2RXH2 2/20 0.49
HTT P42858 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
NAMPT P43490 1/20 0.46
POLB P06746 2/20 0.45
QPCT Q16769 1/20 0.44
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL3504229 0.82 NAMPT (0.50) ROCK2ROCK1SMN1; SMN2KDM4EHTT
SCHEMBL3503297 0.80 NAMPT (0.58) ROCK2ROCK1KDM4ENAMPTMAPT
SCHEMBL3504648 0.79 ROCK2 (0.60) ROCK2ROCK1SMN1; SMN2KDM4EMEN1
SCHEMBL3502434 0.79 ROCK2 (0.65) ROCK2ROCK1SMN1; SMN2KDM4EHTT
SCHEMBL3504202 0.78 ROCK2 (0.58) ROCK2ROCK1SMN1; SMN2KDM4EKMT2A
SCHEMBL3502405 0.78 ROCK2 (0.60) ROCK2ROCK1KDM4EL3MBTL1NAMPT
SCHEMBL3502633 0.78 RAB9A (0.56) ROCK2ROCK1SMN1; SMN2KDM4EHTT
SCHEMBL3504672 0.77 ROCK2 (0.56) ROCK2ROCK1SMN1; SMN2KDM4EMEN1
SCHEMBL3502656 0.76 NAMPT (0.57) ROCK2ROCK1SMN1; SMN2NPC1KDM4E
SCHEMBL3500616 0.75 ROCK2 (0.51) ROCK2ROCK1SMN1; SMN2NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100190788-A1 Amide derivatives as kinase inhitors DEVGEN N.V. (BE) 2010-07-29 US claimed
EP-1907362-A1 AMIDE DERIVATIVES AS KINASE INHIBITORS Devgen NV (BE) 2008-04-09 EP claimed
WO-2007006547-A1 AMIDE DERIVATIVES AS KINASE INHIBITORS DEVGEN N.V. (BE) 2007-01-18 WO claimed
US-20100190788-A1 Amide derivatives as kinase inhitors DEVGEN N.V. (BE) 2010-07-29 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 (1 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-20100190788-A1 Amide derivatives as kinase inhitors MAP3K1, MAPK1, MAP3K21 ROCK2 24/4885ROCK1 10/4885SMN1; SMN2 3251/4885

“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.