SCHEMBL4020457

SCHEMBL4020457

Cc1cccc(C2C(C(=O)c3ccccc3)CN(C(=O)CN(C)C)CC2C(=O)c2ccccc2)c1C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
KIF11 P52732 5/20 0.37
PAX8 Q06710 1/20 0.35
EGFR P00533 2/20 0.34
MAPT P10636 2/20 0.34
RORC P51449 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ALDH1A1 P00352 2/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
HIF1A Q16665 1/20 0.33
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
BTK Q06187 1/20 0.33

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
SCHEMBL4022428 0.87 BLM (0.43) KIF11MAPTALDH1A1USP2LMNA
SCHEMBL4022426 0.87 BLM (0.43) KIF11MAPTALDH1A1USP2LMNA
SCHEMBL4019197 0.87 KIF11 (0.39) KIF11MAPTALDH1A1USP2LMNA
SCHEMBL4022084 0.85 KIF11 (0.38) KIF11MAPTALDH1A1USP2LMNA
SCHEMBL4020371 0.83 KIF11 (0.45) KIF11MAPTALDH1A1USP2LMNA
SCHEMBL4020200 0.83 ALDH1A1 (0.44) KDM4EKIF11ALDH1A1
SCHEMBL4780097 0.82 KIF11 (0.41) KDM4EKIF11RORCHRH3ALDH1A1
SCHEMBL4020344 0.81 KIF11 (0.37) KDM4EKIF11MAPTRORCALDH1A1
SCHEMBL4024526 0.81 KIF11 (0.37) KDM4EKIF11MAPTRORCALDH1A1
SCHEMBL4020347 0.81 KIF11 (0.37) KDM4EKIF11MAPTRORCALDH1A1

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-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US claimed
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 KDM4E 4110/4885KIF11 3745/4885PAX8 2256/4885

“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.