SCHEMBL1630878

SCHEMBL1630878

N#Cc1ccccc1-c1ccc(C(=O)NCc2cccnc2CN(C=O)c2ccc(-c3ccccc3C#N)nc2NCCc2cccc(F)c2)c(NCCc2cccc(F)c2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
MEN1 O00255 4/20 0.38
MAPT P10636 4/20 0.38
KMT2A Q03164 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ADORA2A P29274 4/20 0.37
ADORA1 P30542 4/20 0.37
HIF1A Q16665 1/20 0.33
GAA P10253 1/20 0.33
RPS6KB1 P23443 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDR P35968 1/20 0.32
LMNA P02545 2/20 0.31
HTT P42858 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
AKT1 P31749 1/20 0.31

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
SCHEMBL12724884 0.89 ADORA2A (0.44) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1632318 0.87 ADORA2A (0.42) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL4112138 0.87 ADORA2A (0.43) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1631831 0.87 ADORA2A (0.42) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1630356 0.86 MEN1 (0.39) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL13944318 0.85 MEN1 (0.44) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1632702 0.84 ADORA2A (0.44) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1630422 0.84 KDM4E (0.43) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL1632021 0.84 MAPT (0.43) KDM4EMEN1MAPTKMT2AL3MBTL1
SCHEMBL12725249 0.84 MEN1 (0.43) KDM4EMEN1MAPTKMT2AL3MBTL1

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-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 US claimed
US-7932270-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2011-04-26 US disclosed
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 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-20090012126-A1 Certain chemical entities, compositions, and methods MYLK, MYH2, MYH10 KDM4E 3309/4885MEN1 510/4885MAPT 540/4885

“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.