SCHEMBL4020200

SCHEMBL4020200

CC(=O)NCC(=O)N1CC(C(=O)c2ccccc2)C(c2cccc(C)c2C)C(C(=O)c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KCNH2 Q12809 1/20 0.36
KDM4E B2RXH2 1/20 0.36
KIF11 P52732 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 1/20 0.35
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35

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
SCHEMBL4019197 0.85 KIF11 (0.39) ALDH1A1KIF11SMN1; SMN2KMT2A
SCHEMBL4022428 0.85 BLM (0.43) ALDH1A1KCNH2KIF11KMT2A
SCHEMBL4022426 0.85 BLM (0.43) ALDH1A1KCNH2KIF11KMT2A
SCHEMBL4020371 0.84 KIF11 (0.45) ALDH1A1KIF11KMT2A
SCHEMBL4022084 0.84 KIF11 (0.38) ALDH1A1KIF11SMN1; SMN2KMT2A
SCHEMBL4025723 0.83 MEN1 (0.40) KMT2A
SCHEMBL4025726 0.83 MEN1 (0.40) KMT2A
SCHEMBL4020457 0.83 KDM4E (0.38) ALDH1A1KDM4EKIF11
SCHEMBL4774428 0.79 KMT2A (0.46) ALDH1A1KIF11KMT2A
SCHEMBL4020618 0.78 KIF11 (0.41) ALDH1A1KCNH2KIF11KMT2A

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 ALDH1A1 258/4885KCNH2 3099/4885KDM4E 4110/4885

“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.